MiMeDB: Showing metabocard for Acadesine (MMDBc0033502)

Record Information

Version

2.0

Status

Detected and Quantified

Creation Date

2021-11-19 04:51:17 UTC

Update Date

2025-01-15 19:13:10 UTC

Metabolite ID

MMDBc0033502

Metabolite Identification

Common Name

Acadesine

Description

AICAR also known as ZMP is an analog of AMP that is capable of stimulating AMP-dependent protein kinase activity(AMPK). AICAR is an intermediate in the generation of inosine monophosphate. AICAR is being clinically used to treat and protect against cardiac ischemic injury. AICAR can enter cardiac cells to inhibit adenosine kinase and adenosine deaminase. It enhances the rate of nucleotide re-synthesis increasing adenosine generation from adenosine monophosphate only during conditions of myocardial ischemia. AICAR increases glucose uptake by inducing translocation of GLUT4 and/or by activating the p38 MAPK pathway.

Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Molecular Formula

C₉H₁₅N₄O₈P

Average Mass

338.2112

Monoisotopic Mass

338.06275

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

3031-94-5

SMILES

Not Available

InChI Identifier

InChI=1S/C9H15N4O8P/c10-7-4(8(11)16)12-2-13(7)9-6(15)5(14)3(21-9)1-20-22(17,18)19/h2-3,5-6,9,14-15H,1,10H2,(H2,11,16)(H2,17,18,19)

InChI Key

NOTGFIUVDGNKRI-UHFFFAOYSA-N

Chemical Taxonomy

Functional Ontology

Not Available

Physical Properties

State

Solid

Predicted Properties

Not Available

Spectra

Not Available

Chromatographic Retention Times and Retention Indices

Retention Times

Chromatography Type	Technique	Column	Deposition Date	Retention Time (s)
Liquid Chromatography	HILIC	Waters Acquity UPLC-BEH Amide column (eluted)	2025-10-24	561.5
Liquid Chromatography	HILIC	Accucore 150 Amide HILIC (eluted)	2025-10-24	376.6
Liquid Chromatography	Reversed-phase	Hypersil Gold 1.9 µm C18 (void)	2025-10-24	56.2
Liquid Chromatography	Reversed-phase	Agilent Zorbax Eclipse Plus C18 (2.1 mm x 150 mm, 3.5 um) (eluted)	2025-10-24	255.5
Liquid Chromatography	Reversed-phase	XBridge C18 3.5u 2.1x50 mm (eluted)	2025-10-24	346.3
Liquid Chromatography	Reversed-phase	Ascentis Express C18 (eluted)	2025-10-24	271.7
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC HSS T3 C18 (eluted)	2025-10-24	455.6
Liquid Chromatography	HILIC	Merck SeQuant ZIC-HILIC (eluted)	2025-10-24	865.7
Liquid Chromatography	HILIC	Merck SeQuant ZIC-pHILIC (eluted)	2025-10-24	917.7
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC HSS T3 C18 (eluted)	2025-10-24	154.9
Liquid Chromatography	HILIC	Merck SeQuant ZIC-HILIC (eluted)	2025-10-24	466.3
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC HSS T3 C18 (eluted)	2025-10-24	165.7
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC BEH C18 (eluted)	2025-10-24	28.8
Liquid Chromatography	HILIC	Merck SeQuant ZIC-pHILIC column (eluted)	2025-10-24	478.8
Liquid Chromatography	HILIC	Merck SeQuant ZIC-pHILIC column (eluted)	2025-10-24	953.8
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC BEH C18 (void)	2025-10-24	75.7
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC BEH C18 (eluted)	2025-10-24	313.5
Liquid Chromatography	Reversed-phase	Kinetex Core-Shell C18 2.6 um, 3.0 x 100 mm, Phenomenex (eluted)	2025-10-24	709.9
Liquid Chromatography	Reversed-phase	Waters Atlantis T3 (2.1 x 150 mm, 5 um) (eluted)	2025-10-24	576.3

Retention Indices

Chromatography Type	Peak Label	SMILES	Stationary Phase	Deposition Date	Retention Index
Gas Chromatography	Acadesine_TMS_1	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(N2C=NC(C(=N)O)=C2N)C1O	standard non polar	2025-10-24	2220.55
Gas Chromatography	Acadesine_TMS_2	C[Si](C)(C)OC1C(O)C(COP(=O)(O)O)OC1N1C=NC(C(=N)O)=C1N	standard non polar	2025-10-24	1916.34
Gas Chromatography	Acadesine_TMS_3	C[Si](C)(C)OC(=N)C1=C(N)N(C2OC(COP(=O)(O)O)C(O)C2O)C=N1	standard non polar	2025-10-24	2060.45
Gas Chromatography	Acadesine_TMS_4	C[Si](C)(C)OP(=O)(O)OCC1OC(N2C=NC(C(=N)O)=C2N)C(O)C1O	standard non polar	2025-10-24	1847.49
Gas Chromatography	Acadesine_TMS_5	C[Si](C)(C)NC1=C(C(=N)O)N=CN1C1OC(COP(=O)(O)O)C(O)C1O	standard non polar	2025-10-24	1779.72
Gas Chromatography	Acadesine_TMS_6	C[Si](C)(C)N=C(O)C1=C(N)N(C2OC(COP(=O)(O)O)C(O)C2O)C=N1	standard non polar	2025-10-24	1905.22
Gas Chromatography	Acadesine_TMS_7	C[Si](C)(C)OC(=N)C1=C(N)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O)C=N1	standard non polar	2025-10-24	1935.25
Gas Chromatography	Acadesine_TMS_8	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(N2C=NC(C(=N)O)=C2N)C1O[Si](C)(C)C	standard non polar	2025-10-24	2448.44
Gas Chromatography	Acadesine_TMS_9	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(N2C=NC(C(=N)O)=C2N)C1O	standard non polar	2025-10-24	1991.25
Gas Chromatography	Acadesine_TMS_10	C[Si](C)(C)NC1=C(C(=N)O)N=CN1C1OC(COP(=O)(O)O)C(O[Si](C)(C)C)C1O	standard non polar	2025-10-24	2608.02
Gas Chromatography	Acadesine_TMS_11	C[Si](C)(C)N=C(O)C1=C(N)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O)C=N1	standard non polar	2025-10-24	2675.19
Gas Chromatography	Acadesine_TMS_12	C[Si](C)(C)OC(=N)C1=C(N)N(C2OC(COP(=O)(O)O)C(O)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	2433.06
Gas Chromatography	Acadesine_TMS_13	C[Si](C)(C)OC1C(O)C(COP(=O)(O)O[Si](C)(C)C)OC1N1C=NC(C(=N)O)=C1N	standard non polar	2025-10-24	2477.37
Gas Chromatography	Acadesine_TMS_14	C[Si](C)(C)NC1=C(C(=N)O)N=CN1C1OC(COP(=O)(O)O)C(O)C1O[Si](C)(C)C	standard non polar	2025-10-24	1383.26
Gas Chromatography	Acadesine_TMS_15	C[Si](C)(C)N=C(O)C1=C(N)N(C2OC(COP(=O)(O)O)C(O)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	2171.28
Gas Chromatography	Acadesine_TMS_16	C[Si](C)(C)OC(=N)C1=C(N)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O)C=N1	standard non polar	2025-10-24	2362.77
Gas Chromatography	Acadesine_TMS_17	C[Si](C)(C)NC1=C(C(=N)O[Si](C)(C)C)N=CN1C1OC(COP(=O)(O)O)C(O)C1O	standard non polar	2025-10-24	1494.29
Gas Chromatography	Acadesine_TMS_18	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N)N(C2OC(COP(=O)(O)O)C(O)C2O)C=N1	standard non polar	2025-10-24	2376.4
Gas Chromatography	Acadesine_TMS_19	C[Si](C)(C)OP(=O)(OCC1OC(N2C=NC(C(=N)O)=C2N)C(O)C1O)O[Si](C)(C)C	standard non polar	2025-10-24	1880.36
Gas Chromatography	Acadesine_TMS_20	C[Si](C)(C)NC1=C(C(=N)O)N=CN1C1OC(COP(=O)(O)O[Si](C)(C)C)C(O)C1O	standard non polar	2025-10-24	1965.91
Gas Chromatography	Acadesine_TMS_21	C[Si](C)(C)N=C(O)C1=C(N)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O)C=N1	standard non polar	2025-10-24	2211.52
Gas Chromatography	Acadesine_TMS_22	C[Si](C)(C)N(C1=C(C(=N)O)N=CN1C1OC(COP(=O)(O)O)C(O)C1O)[Si](C)(C)C	standard non polar	2025-10-24	1922.2
Gas Chromatography	Acadesine_TMS_23	C[Si](C)(C)N=C(O)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O)C2O)C=N1	standard non polar	2025-10-24	1841.45
Gas Chromatography	Acadesine_TMS_24	C[Si](C)(C)OC(=N)C1=C(N)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1248.63
Gas Chromatography	Acadesine_TMS_25	C[Si](C)(C)OC(=N)C1=C(N)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard non polar	2025-10-24	1691.72
Gas Chromatography	Acadesine_TMS_26	C[Si](C)(C)NC1=C(C(=N)O[Si](C)(C)C)N=CN1C1OC(COP(=O)(O)O)C(O[Si](C)(C)C)C1O	standard non polar	2025-10-24	2288.43
Gas Chromatography	Acadesine_TMS_27	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O)C=N1	standard non polar	2025-10-24	2455.07
Gas Chromatography	Acadesine_TMS_28	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(N2C=NC(C(=N)O)=C2N)C1O[Si](C)(C)C	standard non polar	2025-10-24	2449.55
Gas Chromatography	Acadesine_TMS_29	C[Si](C)(C)NC1=C(C(=N)O)N=CN1C1OC(COP(=O)(O)O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	standard non polar	2025-10-24	2082.16
Gas Chromatography	Acadesine_TMS_30	C[Si](C)(C)N=C(O)C1=C(N)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	2365.6
Gas Chromatography	Acadesine_TMS_31	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(N2C=NC(C(=N)O)=C2N)C1O	standard non polar	2025-10-24	2029.9
Gas Chromatography	Acadesine_TMS_32	C[Si](C)(C)NC1=C(C(=N)O)N=CN1C1OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	standard non polar	2025-10-24	2481.04
Gas Chromatography	Acadesine_TMS_33	C[Si](C)(C)N=C(O)C1=C(N)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard non polar	2025-10-24	1489.76
Gas Chromatography	Acadesine_TMS_34	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(N2C=NC(C(=N)O)=C2N([Si](C)(C)C)[Si](C)(C)C)C1O	standard non polar	2025-10-24	1916.97
Gas Chromatography	Acadesine_TMS_35	C[Si](C)(C)N=C(O)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O)C=N1	standard non polar	2025-10-24	2017.25
Gas Chromatography	Acadesine_TMS_36	C[Si](C)(C)OC(=N)C1=C(N)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1459.01
Gas Chromatography	Acadesine_TMS_37	C[Si](C)(C)NC1=C(C(=N)O[Si](C)(C)C)N=CN1C1OC(COP(=O)(O)O)C(O)C1O[Si](C)(C)C	standard non polar	2025-10-24	2042.0
Gas Chromatography	Acadesine_TMS_38	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N)N(C2OC(COP(=O)(O)O)C(O)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1944.18
Gas Chromatography	Acadesine_TMS_39	C[Si](C)(C)OC1C(O)C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC1N1C=NC(C(=N)O)=C1N	standard non polar	2025-10-24	1619.76
Gas Chromatography	Acadesine_TMS_40	C[Si](C)(C)NC1=C(C(=N)O)N=CN1C1OC(COP(=O)(O)O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	standard non polar	2025-10-24	1810.3
Gas Chromatography	Acadesine_TMS_41	C[Si](C)(C)N=C(O)C1=C(N)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1819.12
Gas Chromatography	Acadesine_TMS_42	C[Si](C)(C)OC1C(O)C(COP(=O)(O)O)OC1N1C=NC(C(=N)O)=C1N([Si](C)(C)C)[Si](C)(C)C	standard non polar	2025-10-24	2872.76
Gas Chromatography	Acadesine_TMS_43	C[Si](C)(C)N=C(O)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1758.53
Gas Chromatography	Acadesine_TMS_44	C[Si](C)(C)OC(=N)C1=C(N)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O)C=N1	standard non polar	2025-10-24	1645.0
Gas Chromatography	Acadesine_TMS_45	C[Si](C)(C)NC1=C(C(=N)O[Si](C)(C)C)N=CN1C1OC(COP(=O)(O)O[Si](C)(C)C)C(O)C1O	standard non polar	2025-10-24	1560.57
Gas Chromatography	Acadesine_TMS_46	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O)C=N1	standard non polar	2025-10-24	1509.05
Gas Chromatography	Acadesine_TMS_47	C[Si](C)(C)OC(=N)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O)C2O)C=N1	standard non polar	2025-10-24	2367.43
Gas Chromatography	Acadesine_TMS_48	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O)C2O)C=N1	standard non polar	2025-10-24	869.993
Gas Chromatography	Acadesine_TMS_49	C[Si](C)(C)NC1=C(C(=N)O)N=CN1C1OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O	standard non polar	2025-10-24	3204.28
Gas Chromatography	Acadesine_TMS_50	C[Si](C)(C)N=C(O)C1=C(N)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O)C=N1	standard non polar	2025-10-24	1696.97
Gas Chromatography	Acadesine_TMS_51	C[Si](C)(C)OP(=O)(O)OCC1OC(N2C=NC(C(=N)O)=C2N([Si](C)(C)C)[Si](C)(C)C)C(O)C1O	standard non polar	2025-10-24	1625.7
Gas Chromatography	Acadesine_TMS_52	C[Si](C)(C)N=C(O)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O)C=N1	standard non polar	2025-10-24	2339.08
Gas Chromatography	Acadesine_TMS_53	C[Si](C)(C)N=C(O)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O)C2O)C=N1	standard non polar	2025-10-24	3202.34
Gas Chromatography	Acadesine_TMS_54	C[Si](C)(C)OC(=N)C1=C(N)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	775.203
Gas Chromatography	Acadesine_TMS_55	C[Si](C)(C)NC1=C(C(=N)O[Si](C)(C)C)N=CN1C1OC(COP(=O)(O)O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	standard non polar	2025-10-24	1914.53
Gas Chromatography	Acadesine_TMS_56	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	2161.07
Gas Chromatography	Acadesine_TMS_57	C[Si](C)(C)OC(=N)C1=C(N)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard non polar	2025-10-24	2231.14
Gas Chromatography	Acadesine_TMS_58	C[Si](C)(C)NC1=C(C(=N)O[Si](C)(C)C)N=CN1C1OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	standard non polar	2025-10-24	1777.49
Gas Chromatography	Acadesine_TMS_59	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard non polar	2025-10-24	2193.55
Gas Chromatography	Acadesine_TMS_60	C[Si](C)(C)OC(=N)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O)C=N1	standard non polar	2025-10-24	1554.34
Gas Chromatography	Acadesine_TMS_61	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O)C=N1	standard non polar	2025-10-24	1190.42
Gas Chromatography	Acadesine_TMS_62	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(N2C=NC(C(=N)O)=C2N)C1O[Si](C)(C)C	standard non polar	2025-10-24	1415.53
Gas Chromatography	Acadesine_TMS_63	C[Si](C)(C)NC1=C(C(=N)O)N=CN1C1OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	standard non polar	2025-10-24	969.708
Gas Chromatography	Acadesine_TMS_64	C[Si](C)(C)N=C(O)C1=C(N)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	2103.11
Gas Chromatography	Acadesine_TMS_65	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(N2C=NC(C(=N)O)=C2N([Si](C)(C)C)[Si](C)(C)C)C1O[Si](C)(C)C	standard non polar	2025-10-24	1420.63
Gas Chromatography	Acadesine_TMS_66	C[Si](C)(C)N=C(O)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1645.67
Gas Chromatography	Acadesine_TMS_67	C[Si](C)(C)NC1=C(C(=N)O)N=CN1C1OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	standard non polar	2025-10-24	2709.3
Gas Chromatography	Acadesine_TMS_68	C[Si](C)(C)N=C(O)C1=C(N)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard non polar	2025-10-24	2021.45
Gas Chromatography	Acadesine_TMS_69	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(N2C=NC(C(=N)O)=C2N([Si](C)(C)C)[Si](C)(C)C)C1O	standard non polar	2025-10-24	1934.13
Gas Chromatography	Acadesine_TMS_70	C[Si](C)(C)N=C(O)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard non polar	2025-10-24	1472.02
Gas Chromatography	Acadesine_TMS_71	C[Si](C)(C)N=C(O)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O)C=N1	standard non polar	2025-10-24	2285.15
Gas Chromatography	Acadesine_TMS_72	C[Si](C)(C)OC(=N)C1=C(N)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	2663.41
Gas Chromatography	Acadesine_TMS_73	C[Si](C)(C)NC1=C(C(=N)O[Si](C)(C)C)N=CN1C1OC(COP(=O)(O)O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	standard non polar	2025-10-24	1865.17
Gas Chromatography	Acadesine_TMS_74	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1407.72
Gas Chromatography	Acadesine_TMS_75	C[Si](C)(C)OC(=N)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1886.1
Gas Chromatography	Acadesine_TMS_76	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1718.37
Gas Chromatography	Acadesine_TMS_77	C[Si](C)(C)NC1=C(C(=N)O)N=CN1C1OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	standard non polar	2025-10-24	2768.74
Gas Chromatography	Acadesine_TMS_78	C[Si](C)(C)N=C(O)C1=C(N)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1901.46
Gas Chromatography	Acadesine_TMS_79	C[Si](C)(C)OC1C(O)C(COP(=O)(O)O[Si](C)(C)C)OC1N1C=NC(C(=N)O)=C1N([Si](C)(C)C)[Si](C)(C)C	standard non polar	2025-10-24	1620.55
Gas Chromatography	Acadesine_TMS_80	C[Si](C)(C)N=C(O)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	2542.94
Gas Chromatography	Acadesine_TMS_81	C[Si](C)(C)N=C(O)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1141.22
Gas Chromatography	Acadesine_TMS_82	C[Si](C)(C)NC1=C(C(=N)O[Si](C)(C)C)N=CN1C1OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O	standard non polar	2025-10-24	1437.76
Gas Chromatography	Acadesine_TMS_83	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O)C=N1	standard non polar	2025-10-24	1989.4
Gas Chromatography	Acadesine_TMS_84	C[Si](C)(C)OC(=N)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O)C=N1	standard non polar	2025-10-24	2054.19
Gas Chromatography	Acadesine_TMS_85	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O)C=N1	standard non polar	2025-10-24	2331.24
Gas Chromatography	Acadesine_TMS_86	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O)C2O)C=N1	standard non polar	2025-10-24	1302.92
Gas Chromatography	Acadesine_TMS_87	C[Si](C)(C)OP(=O)(OCC1OC(N2C=NC(C(=N)O)=C2N([Si](C)(C)C)[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	standard non polar	2025-10-24	2071.74
Gas Chromatography	Acadesine_TMS_88	C[Si](C)(C)N=C(O)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O)C=N1	standard non polar	2025-10-24	2382.53
Gas Chromatography	Acadesine_TMS_89	C[Si](C)(C)N=C(O)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O)C=N1	standard non polar	2025-10-24	2363.99
Gas Chromatography	Acadesine_TMS_90	C[Si](C)(C)OC(=N)C1=C(N)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1451.94
Gas Chromatography	Acadesine_TMS_91	C[Si](C)(C)NC1=C(C(=N)O[Si](C)(C)C)N=CN1C1OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	standard non polar	2025-10-24	2248.26
Gas Chromatography	Acadesine_TMS_92	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1657.19
Gas Chromatography	Acadesine_TMS_93	C[Si](C)(C)OC(=N)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1436.53
Gas Chromatography	Acadesine_TMS_94	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1101.46
Gas Chromatography	Acadesine_TMS_95	C[Si](C)(C)NC1=C(C(=N)O[Si](C)(C)C)N=CN1C1OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	standard non polar	2025-10-24	1139.52
Gas Chromatography	Acadesine_TMS_96	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard non polar	2025-10-24	2395.2
Gas Chromatography	Acadesine_TMS_97	C[Si](C)(C)OC(=N)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard non polar	2025-10-24	2166.76
Gas Chromatography	Acadesine_TMS_98	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard non polar	2025-10-24	894.849
Gas Chromatography	Acadesine_TMS_99	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O)C=N1	standard non polar	2025-10-24	2243.84
Gas Chromatography	Acadesine_TMS_100	C[Si](C)(C)NC1=C(C(=N)O)N=CN1C1OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	standard non polar	2025-10-24	1370.88
Gas Chromatography	Acadesine_TMS_101	C[Si](C)(C)N=C(O)C1=C(N)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	2566.37
Gas Chromatography	Acadesine_TMS_102	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(N2C=NC(C(=N)O)=C2N([Si](C)(C)C)[Si](C)(C)C)C1O[Si](C)(C)C	standard non polar	2025-10-24	476.902
Gas Chromatography	Acadesine_TMS_103	C[Si](C)(C)N=C(O)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1495.99
Gas Chromatography	Acadesine_TMS_104	C[Si](C)(C)N=C(O)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	2288.27
Gas Chromatography	Acadesine_TMS_105	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(N2C=NC(C(=N)O)=C2N([Si](C)(C)C)[Si](C)(C)C)C1O	standard non polar	2025-10-24	1545.55
Gas Chromatography	Acadesine_TMS_106	C[Si](C)(C)N=C(O)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard non polar	2025-10-24	1908.4
Gas Chromatography	Acadesine_TMS_107	C[Si](C)(C)N=C(O)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard non polar	2025-10-24	1468.74
Gas Chromatography	Acadesine_TMS_108	C[Si](C)(C)NC1=C(C(=N)O[Si](C)(C)C)N=CN1C1OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	standard non polar	2025-10-24	2229.63
Gas Chromatography	Acadesine_TMS_109	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1835.99
Gas Chromatography	Acadesine_TMS_110	C[Si](C)(C)OC(=N)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	3196.43
Gas Chromatography	Acadesine_TMS_111	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	2073.6
Gas Chromatography	Acadesine_TMS_112	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1397.39
Gas Chromatography	Acadesine_TMS_113	C[Si](C)(C)OC1C(O)C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC1N1C=NC(C(=N)O)=C1N([Si](C)(C)C)[Si](C)(C)C	standard non polar	2025-10-24	2350.37
Gas Chromatography	Acadesine_TMS_114	C[Si](C)(C)N=C(O)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	2440.68
Gas Chromatography	Acadesine_TMS_115	C[Si](C)(C)N=C(O)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	2094.82
Gas Chromatography	Acadesine_TMS_116	C[Si](C)(C)OC(=N)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O)C=N1	standard non polar	2025-10-24	3099.41
Gas Chromatography	Acadesine_TMS_117	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O)C=N1	standard non polar	2025-10-24	1879.63
Gas Chromatography	Acadesine_TMS_118	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O)C=N1	standard non polar	2025-10-24	2745.63
Gas Chromatography	Acadesine_TMS_119	C[Si](C)(C)N=C(O)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O)C=N1	standard non polar	2025-10-24	2329.67
Gas Chromatography	Acadesine_TMS_120	C[Si](C)(C)NC1=C(C(=N)O[Si](C)(C)C)N=CN1C1OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	standard non polar	2025-10-24	1235.34
Gas Chromatography	Acadesine_TMS_121	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	3028.21
Gas Chromatography	Acadesine_TMS_122	C[Si](C)(C)OC(=N)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1102.72
Gas Chromatography	Acadesine_TMS_123	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1590.1
Gas Chromatography	Acadesine_TMS_124	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1307.84
Gas Chromatography	Acadesine_TMS_125	C[Si](C)(C)OC(=N)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard non polar	2025-10-24	1627.35
Gas Chromatography	Acadesine_TMS_126	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard non polar	2025-10-24	1869.25
Gas Chromatography	Acadesine_TMS_127	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard non polar	2025-10-24	1447.12
Gas Chromatography	Acadesine_TMS_128	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(N2C=NC(C(=N)O)=C2N([Si](C)(C)C)[Si](C)(C)C)C1O[Si](C)(C)C	standard non polar	2025-10-24	1093.97
Gas Chromatography	Acadesine_TMS_129	C[Si](C)(C)N=C(O)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1958.24
Gas Chromatography	Acadesine_TMS_130	C[Si](C)(C)N=C(O)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1553.72
Gas Chromatography	Acadesine_TMS_131	C[Si](C)(C)N=C(O)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard non polar	2025-10-24	2104.44
Gas Chromatography	Acadesine_TMS_132	C[Si](C)(C)OC(=N)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1160.12
Gas Chromatography	Acadesine_TMS_133	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1559.99
Gas Chromatography	Acadesine_TMS_134	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	792.928
Gas Chromatography	Acadesine_TMS_135	C[Si](C)(C)N=C(O)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1977.02
Gas Chromatography	Acadesine_TMS_136	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O)C=N1	standard non polar	2025-10-24	1311.05
Gas Chromatography	Acadesine_TMS_137	C[Si](C)(C)OC(=N)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	2558.7
Gas Chromatography	Acadesine_TMS_138	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1949.92
Gas Chromatography	Acadesine_TMS_139	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	2222.51
Gas Chromatography	Acadesine_TMS_140	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard non polar	2025-10-24	2773.99
Gas Chromatography	Acadesine_TMS_141	C[Si](C)(C)N=C(O)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1833.02
Gas Chromatography	Acadesine_TMS_142	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard non polar	2025-10-24	1529.01
Gas Chromatography	Acadesine_TMS_1	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(N2C=NC(C(=N)O)=C2N)C1O	standard polar	2025-10-24	1291.96
Gas Chromatography	Acadesine_TMS_2	C[Si](C)(C)OC1C(O)C(COP(=O)(O)O)OC1N1C=NC(C(=N)O)=C1N	standard polar	2025-10-24	1888.01
Gas Chromatography	Acadesine_TMS_3	C[Si](C)(C)OC(=N)C1=C(N)N(C2OC(COP(=O)(O)O)C(O)C2O)C=N1	standard polar	2025-10-24	2059.34
Gas Chromatography	Acadesine_TMS_4	C[Si](C)(C)OP(=O)(O)OCC1OC(N2C=NC(C(=N)O)=C2N)C(O)C1O	standard polar	2025-10-24	2294.0
Gas Chromatography	Acadesine_TMS_5	C[Si](C)(C)NC1=C(C(=N)O)N=CN1C1OC(COP(=O)(O)O)C(O)C1O	standard polar	2025-10-24	2135.48
Gas Chromatography	Acadesine_TMS_6	C[Si](C)(C)N=C(O)C1=C(N)N(C2OC(COP(=O)(O)O)C(O)C2O)C=N1	standard polar	2025-10-24	2186.5
Gas Chromatography	Acadesine_TMS_7	C[Si](C)(C)OC(=N)C1=C(N)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O)C=N1	standard polar	2025-10-24	1480.77
Gas Chromatography	Acadesine_TMS_8	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(N2C=NC(C(=N)O)=C2N)C1O[Si](C)(C)C	standard polar	2025-10-24	1579.98
Gas Chromatography	Acadesine_TMS_9	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(N2C=NC(C(=N)O)=C2N)C1O	standard polar	2025-10-24	2302.47
Gas Chromatography	Acadesine_TMS_10	C[Si](C)(C)NC1=C(C(=N)O)N=CN1C1OC(COP(=O)(O)O)C(O[Si](C)(C)C)C1O	standard polar	2025-10-24	1733.61
Gas Chromatography	Acadesine_TMS_11	C[Si](C)(C)N=C(O)C1=C(N)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O)C=N1	standard polar	2025-10-24	1832.08
Gas Chromatography	Acadesine_TMS_12	C[Si](C)(C)OC(=N)C1=C(N)N(C2OC(COP(=O)(O)O)C(O)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	2412.1
Gas Chromatography	Acadesine_TMS_13	C[Si](C)(C)OC1C(O)C(COP(=O)(O)O[Si](C)(C)C)OC1N1C=NC(C(=N)O)=C1N	standard polar	2025-10-24	1837.93
Gas Chromatography	Acadesine_TMS_14	C[Si](C)(C)NC1=C(C(=N)O)N=CN1C1OC(COP(=O)(O)O)C(O)C1O[Si](C)(C)C	standard polar	2025-10-24	1415.77
Gas Chromatography	Acadesine_TMS_15	C[Si](C)(C)N=C(O)C1=C(N)N(C2OC(COP(=O)(O)O)C(O)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	1185.81
Gas Chromatography	Acadesine_TMS_16	C[Si](C)(C)OC(=N)C1=C(N)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O)C=N1	standard polar	2025-10-24	1377.02
Gas Chromatography	Acadesine_TMS_17	C[Si](C)(C)NC1=C(C(=N)O[Si](C)(C)C)N=CN1C1OC(COP(=O)(O)O)C(O)C1O	standard polar	2025-10-24	2394.65
Gas Chromatography	Acadesine_TMS_18	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N)N(C2OC(COP(=O)(O)O)C(O)C2O)C=N1	standard polar	2025-10-24	2249.2
Gas Chromatography	Acadesine_TMS_19	C[Si](C)(C)OP(=O)(OCC1OC(N2C=NC(C(=N)O)=C2N)C(O)C1O)O[Si](C)(C)C	standard polar	2025-10-24	1708.28
Gas Chromatography	Acadesine_TMS_20	C[Si](C)(C)NC1=C(C(=N)O)N=CN1C1OC(COP(=O)(O)O[Si](C)(C)C)C(O)C1O	standard polar	2025-10-24	2217.23
Gas Chromatography	Acadesine_TMS_21	C[Si](C)(C)N=C(O)C1=C(N)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O)C=N1	standard polar	2025-10-24	2059.15
Gas Chromatography	Acadesine_TMS_22	C[Si](C)(C)N(C1=C(C(=N)O)N=CN1C1OC(COP(=O)(O)O)C(O)C1O)[Si](C)(C)C	standard polar	2025-10-24	1270.2
Gas Chromatography	Acadesine_TMS_23	C[Si](C)(C)N=C(O)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O)C2O)C=N1	standard polar	2025-10-24	1763.29
Gas Chromatography	Acadesine_TMS_24	C[Si](C)(C)OC(=N)C1=C(N)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	1871.47
Gas Chromatography	Acadesine_TMS_25	C[Si](C)(C)OC(=N)C1=C(N)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard polar	2025-10-24	1505.61
Gas Chromatography	Acadesine_TMS_26	C[Si](C)(C)NC1=C(C(=N)O[Si](C)(C)C)N=CN1C1OC(COP(=O)(O)O)C(O[Si](C)(C)C)C1O	standard polar	2025-10-24	1844.14
Gas Chromatography	Acadesine_TMS_27	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O)C=N1	standard polar	2025-10-24	1253.49
Gas Chromatography	Acadesine_TMS_28	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(N2C=NC(C(=N)O)=C2N)C1O[Si](C)(C)C	standard polar	2025-10-24	1405.84
Gas Chromatography	Acadesine_TMS_29	C[Si](C)(C)NC1=C(C(=N)O)N=CN1C1OC(COP(=O)(O)O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	standard polar	2025-10-24	2440.49
Gas Chromatography	Acadesine_TMS_30	C[Si](C)(C)N=C(O)C1=C(N)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	1615.39
Gas Chromatography	Acadesine_TMS_31	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(N2C=NC(C(=N)O)=C2N)C1O	standard polar	2025-10-24	1665.68
Gas Chromatography	Acadesine_TMS_32	C[Si](C)(C)NC1=C(C(=N)O)N=CN1C1OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	standard polar	2025-10-24	2461.52
Gas Chromatography	Acadesine_TMS_33	C[Si](C)(C)N=C(O)C1=C(N)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard polar	2025-10-24	2537.08
Gas Chromatography	Acadesine_TMS_34	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(N2C=NC(C(=N)O)=C2N([Si](C)(C)C)[Si](C)(C)C)C1O	standard polar	2025-10-24	1565.17
Gas Chromatography	Acadesine_TMS_35	C[Si](C)(C)N=C(O)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O)C=N1	standard polar	2025-10-24	1334.37
Gas Chromatography	Acadesine_TMS_36	C[Si](C)(C)OC(=N)C1=C(N)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	996.245
Gas Chromatography	Acadesine_TMS_37	C[Si](C)(C)NC1=C(C(=N)O[Si](C)(C)C)N=CN1C1OC(COP(=O)(O)O)C(O)C1O[Si](C)(C)C	standard polar	2025-10-24	1390.28
Gas Chromatography	Acadesine_TMS_38	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N)N(C2OC(COP(=O)(O)O)C(O)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	2019.23
Gas Chromatography	Acadesine_TMS_39	C[Si](C)(C)OC1C(O)C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC1N1C=NC(C(=N)O)=C1N	standard polar	2025-10-24	1407.89
Gas Chromatography	Acadesine_TMS_40	C[Si](C)(C)NC1=C(C(=N)O)N=CN1C1OC(COP(=O)(O)O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	standard polar	2025-10-24	2790.66
Gas Chromatography	Acadesine_TMS_41	C[Si](C)(C)N=C(O)C1=C(N)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	2521.52
Gas Chromatography	Acadesine_TMS_42	C[Si](C)(C)OC1C(O)C(COP(=O)(O)O)OC1N1C=NC(C(=N)O)=C1N([Si](C)(C)C)[Si](C)(C)C	standard polar	2025-10-24	1263.96
Gas Chromatography	Acadesine_TMS_43	C[Si](C)(C)N=C(O)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	1942.71
Gas Chromatography	Acadesine_TMS_44	C[Si](C)(C)OC(=N)C1=C(N)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O)C=N1	standard polar	2025-10-24	2438.03
Gas Chromatography	Acadesine_TMS_45	C[Si](C)(C)NC1=C(C(=N)O[Si](C)(C)C)N=CN1C1OC(COP(=O)(O)O[Si](C)(C)C)C(O)C1O	standard polar	2025-10-24	1584.62
Gas Chromatography	Acadesine_TMS_46	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O)C=N1	standard polar	2025-10-24	2929.42
Gas Chromatography	Acadesine_TMS_47	C[Si](C)(C)OC(=N)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O)C2O)C=N1	standard polar	2025-10-24	2855.67
Gas Chromatography	Acadesine_TMS_48	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O)C2O)C=N1	standard polar	2025-10-24	2243.21
Gas Chromatography	Acadesine_TMS_49	C[Si](C)(C)NC1=C(C(=N)O)N=CN1C1OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O	standard polar	2025-10-24	1356.34
Gas Chromatography	Acadesine_TMS_50	C[Si](C)(C)N=C(O)C1=C(N)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O)C=N1	standard polar	2025-10-24	2047.48
Gas Chromatography	Acadesine_TMS_51	C[Si](C)(C)OP(=O)(O)OCC1OC(N2C=NC(C(=N)O)=C2N([Si](C)(C)C)[Si](C)(C)C)C(O)C1O	standard polar	2025-10-24	1525.78
Gas Chromatography	Acadesine_TMS_52	C[Si](C)(C)N=C(O)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O)C=N1	standard polar	2025-10-24	1458.42
Gas Chromatography	Acadesine_TMS_53	C[Si](C)(C)N=C(O)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O)C2O)C=N1	standard polar	2025-10-24	2270.45
Gas Chromatography	Acadesine_TMS_54	C[Si](C)(C)OC(=N)C1=C(N)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	1675.49
Gas Chromatography	Acadesine_TMS_55	C[Si](C)(C)NC1=C(C(=N)O[Si](C)(C)C)N=CN1C1OC(COP(=O)(O)O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	standard polar	2025-10-24	2904.66
Gas Chromatography	Acadesine_TMS_56	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	1479.32
Gas Chromatography	Acadesine_TMS_57	C[Si](C)(C)OC(=N)C1=C(N)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard polar	2025-10-24	2020.28
Gas Chromatography	Acadesine_TMS_58	C[Si](C)(C)NC1=C(C(=N)O[Si](C)(C)C)N=CN1C1OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	standard polar	2025-10-24	3215.95
Gas Chromatography	Acadesine_TMS_59	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard polar	2025-10-24	2961.22
Gas Chromatography	Acadesine_TMS_60	C[Si](C)(C)OC(=N)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O)C=N1	standard polar	2025-10-24	2309.56
Gas Chromatography	Acadesine_TMS_61	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O)C=N1	standard polar	2025-10-24	1401.32
Gas Chromatography	Acadesine_TMS_62	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(N2C=NC(C(=N)O)=C2N)C1O[Si](C)(C)C	standard polar	2025-10-24	2208.77
Gas Chromatography	Acadesine_TMS_63	C[Si](C)(C)NC1=C(C(=N)O)N=CN1C1OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	standard polar	2025-10-24	2204.94
Gas Chromatography	Acadesine_TMS_64	C[Si](C)(C)N=C(O)C1=C(N)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	2921.9
Gas Chromatography	Acadesine_TMS_65	C[Si](C)(C)OC1C(COP(=O)(O)O)OC(N2C=NC(C(=N)O)=C2N([Si](C)(C)C)[Si](C)(C)C)C1O[Si](C)(C)C	standard polar	2025-10-24	2915.4
Gas Chromatography	Acadesine_TMS_66	C[Si](C)(C)N=C(O)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	2677.6
Gas Chromatography	Acadesine_TMS_67	C[Si](C)(C)NC1=C(C(=N)O)N=CN1C1OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	standard polar	2025-10-24	1721.85
Gas Chromatography	Acadesine_TMS_68	C[Si](C)(C)N=C(O)C1=C(N)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard polar	2025-10-24	3315.66
Gas Chromatography	Acadesine_TMS_69	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(N2C=NC(C(=N)O)=C2N([Si](C)(C)C)[Si](C)(C)C)C1O	standard polar	2025-10-24	2853.79
Gas Chromatography	Acadesine_TMS_70	C[Si](C)(C)N=C(O)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard polar	2025-10-24	1448.41
Gas Chromatography	Acadesine_TMS_71	C[Si](C)(C)N=C(O)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O)C=N1	standard polar	2025-10-24	2310.28
Gas Chromatography	Acadesine_TMS_72	C[Si](C)(C)OC(=N)C1=C(N)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	953.605
Gas Chromatography	Acadesine_TMS_73	C[Si](C)(C)NC1=C(C(=N)O[Si](C)(C)C)N=CN1C1OC(COP(=O)(O)O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	standard polar	2025-10-24	2808.48
Gas Chromatography	Acadesine_TMS_74	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	2920.49
Gas Chromatography	Acadesine_TMS_75	C[Si](C)(C)OC(=N)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	2913.38
Gas Chromatography	Acadesine_TMS_76	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	1643.8
Gas Chromatography	Acadesine_TMS_77	C[Si](C)(C)NC1=C(C(=N)O)N=CN1C1OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	standard polar	2025-10-24	1560.12
Gas Chromatography	Acadesine_TMS_78	C[Si](C)(C)N=C(O)C1=C(N)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	1955.9
Gas Chromatography	Acadesine_TMS_79	C[Si](C)(C)OC1C(O)C(COP(=O)(O)O[Si](C)(C)C)OC1N1C=NC(C(=N)O)=C1N([Si](C)(C)C)[Si](C)(C)C	standard polar	2025-10-24	1887.04
Gas Chromatography	Acadesine_TMS_80	C[Si](C)(C)N=C(O)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	1842.53
Gas Chromatography	Acadesine_TMS_81	C[Si](C)(C)N=C(O)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	2419.84
Gas Chromatography	Acadesine_TMS_82	C[Si](C)(C)NC1=C(C(=N)O[Si](C)(C)C)N=CN1C1OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O	standard polar	2025-10-24	1804.54
Gas Chromatography	Acadesine_TMS_83	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O)C=N1	standard polar	2025-10-24	1094.46
Gas Chromatography	Acadesine_TMS_84	C[Si](C)(C)OC(=N)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O)C=N1	standard polar	2025-10-24	2190.15
Gas Chromatography	Acadesine_TMS_85	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O)C=N1	standard polar	2025-10-24	1220.55
Gas Chromatography	Acadesine_TMS_86	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O)C2O)C=N1	standard polar	2025-10-24	2323.91
Gas Chromatography	Acadesine_TMS_87	C[Si](C)(C)OP(=O)(OCC1OC(N2C=NC(C(=N)O)=C2N([Si](C)(C)C)[Si](C)(C)C)C(O)C1O)O[Si](C)(C)C	standard polar	2025-10-24	2020.63
Gas Chromatography	Acadesine_TMS_88	C[Si](C)(C)N=C(O)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O)C=N1	standard polar	2025-10-24	2525.37
Gas Chromatography	Acadesine_TMS_89	C[Si](C)(C)N=C(O)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O)C=N1	standard polar	2025-10-24	2447.88
Gas Chromatography	Acadesine_TMS_90	C[Si](C)(C)OC(=N)C1=C(N)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	1914.13
Gas Chromatography	Acadesine_TMS_91	C[Si](C)(C)NC1=C(C(=N)O[Si](C)(C)C)N=CN1C1OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	standard polar	2025-10-24	1787.34
Gas Chromatography	Acadesine_TMS_92	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	1322.96
Gas Chromatography	Acadesine_TMS_93	C[Si](C)(C)OC(=N)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	1961.02
Gas Chromatography	Acadesine_TMS_94	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	1396.1
Gas Chromatography	Acadesine_TMS_95	C[Si](C)(C)NC1=C(C(=N)O[Si](C)(C)C)N=CN1C1OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	standard polar	2025-10-24	2522.65
Gas Chromatography	Acadesine_TMS_96	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard polar	2025-10-24	1782.33
Gas Chromatography	Acadesine_TMS_97	C[Si](C)(C)OC(=N)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard polar	2025-10-24	3184.49
Gas Chromatography	Acadesine_TMS_98	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard polar	2025-10-24	1393.44
Gas Chromatography	Acadesine_TMS_99	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O)C=N1	standard polar	2025-10-24	1931.84
Gas Chromatography	Acadesine_TMS_100	C[Si](C)(C)NC1=C(C(=N)O)N=CN1C1OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	standard polar	2025-10-24	1898.7
Gas Chromatography	Acadesine_TMS_101	C[Si](C)(C)N=C(O)C1=C(N)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	888.163
Gas Chromatography	Acadesine_TMS_102	C[Si](C)(C)OC1C(COP(=O)(O)O[Si](C)(C)C)OC(N2C=NC(C(=N)O)=C2N([Si](C)(C)C)[Si](C)(C)C)C1O[Si](C)(C)C	standard polar	2025-10-24	2398.54
Gas Chromatography	Acadesine_TMS_103	C[Si](C)(C)N=C(O)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	1791.41
Gas Chromatography	Acadesine_TMS_104	C[Si](C)(C)N=C(O)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	2396.13
Gas Chromatography	Acadesine_TMS_105	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(N2C=NC(C(=N)O)=C2N([Si](C)(C)C)[Si](C)(C)C)C1O	standard polar	2025-10-24	1906.43
Gas Chromatography	Acadesine_TMS_106	C[Si](C)(C)N=C(O)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard polar	2025-10-24	1695.27
Gas Chromatography	Acadesine_TMS_107	C[Si](C)(C)N=C(O)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard polar	2025-10-24	2338.59
Gas Chromatography	Acadesine_TMS_108	C[Si](C)(C)NC1=C(C(=N)O[Si](C)(C)C)N=CN1C1OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	standard polar	2025-10-24	1480.83
Gas Chromatography	Acadesine_TMS_109	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	2433.82
Gas Chromatography	Acadesine_TMS_110	C[Si](C)(C)OC(=N)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	2860.63
Gas Chromatography	Acadesine_TMS_111	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	1952.38
Gas Chromatography	Acadesine_TMS_112	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	1309.63
Gas Chromatography	Acadesine_TMS_113	C[Si](C)(C)OC1C(O)C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC1N1C=NC(C(=N)O)=C1N([Si](C)(C)C)[Si](C)(C)C	standard polar	2025-10-24	2601.37
Gas Chromatography	Acadesine_TMS_114	C[Si](C)(C)N=C(O)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	1323.68
Gas Chromatography	Acadesine_TMS_115	C[Si](C)(C)N=C(O)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	3540.16
Gas Chromatography	Acadesine_TMS_116	C[Si](C)(C)OC(=N)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O)C=N1	standard polar	2025-10-24	1511.84
Gas Chromatography	Acadesine_TMS_117	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O)C=N1	standard polar	2025-10-24	1418.62
Gas Chromatography	Acadesine_TMS_118	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O)C=N1	standard polar	2025-10-24	2177.68
Gas Chromatography	Acadesine_TMS_119	C[Si](C)(C)N=C(O)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O)C=N1	standard polar	2025-10-24	1631.85
Gas Chromatography	Acadesine_TMS_120	C[Si](C)(C)NC1=C(C(=N)O[Si](C)(C)C)N=CN1C1OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	standard polar	2025-10-24	2345.44
Gas Chromatography	Acadesine_TMS_121	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	1390.88
Gas Chromatography	Acadesine_TMS_122	C[Si](C)(C)OC(=N)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	3257.82
Gas Chromatography	Acadesine_TMS_123	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	2774.14
Gas Chromatography	Acadesine_TMS_124	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	2218.7
Gas Chromatography	Acadesine_TMS_125	C[Si](C)(C)OC(=N)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard polar	2025-10-24	2062.17
Gas Chromatography	Acadesine_TMS_126	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard polar	2025-10-24	2398.2
Gas Chromatography	Acadesine_TMS_127	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard polar	2025-10-24	1294.32
Gas Chromatography	Acadesine_TMS_128	C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)OC(N2C=NC(C(=N)O)=C2N([Si](C)(C)C)[Si](C)(C)C)C1O[Si](C)(C)C	standard polar	2025-10-24	1757.93
Gas Chromatography	Acadesine_TMS_129	C[Si](C)(C)N=C(O)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	945.734
Gas Chromatography	Acadesine_TMS_130	C[Si](C)(C)N=C(O)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	1270.89
Gas Chromatography	Acadesine_TMS_131	C[Si](C)(C)N=C(O)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard polar	2025-10-24	1385.26
Gas Chromatography	Acadesine_TMS_132	C[Si](C)(C)OC(=N)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	-211.131
Gas Chromatography	Acadesine_TMS_133	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	3566.43
Gas Chromatography	Acadesine_TMS_134	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	2158.92
Gas Chromatography	Acadesine_TMS_135	C[Si](C)(C)N=C(O)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	1696.88
Gas Chromatography	Acadesine_TMS_136	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O)C=N1	standard polar	2025-10-24	1174.71
Gas Chromatography	Acadesine_TMS_137	C[Si](C)(C)OC(=N)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	1894.77
Gas Chromatography	Acadesine_TMS_138	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	1116.07
Gas Chromatography	Acadesine_TMS_139	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	3257.06
Gas Chromatography	Acadesine_TMS_140	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=N1	standard polar	2025-10-24	1515.97
Gas Chromatography	Acadesine_TMS_141	C[Si](C)(C)N=C(O)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	3228.18
Gas Chromatography	Acadesine_TMS_142	C[Si](C)(C)N=C(O[Si](C)(C)C)C1=C(N([Si](C)(C)C)[Si](C)(C)C)N(C2OC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=N1	standard polar	2025-10-24	2454.78

Biological Properties

Cellular Locations

Cytoplasm

Biospecimen Locations

Saliva
Skeletal Muscle

Tissue Locations

Not Available

Associated OMIM IDs

114500 (Colorectal cancer)
610247 (Eosinophilic esophagitis)

Human Proteins and Enzymes

Protein ID	Protein Name	Protein Type	Uniprot ID	Species

Human Pathways

Pathways

Name	SMPDB/PathBank

Microbial Pathways

Pathways

Not Available

Metabolic Reactions

Reactions

This table shows at most 20 reactions. For the full list of associated reactions:

See All Associated Reactions

Reaction ID	Precursor	Product	Enzyme	Reaction Type	Data Source	Reference

Health Effects and Bioactivity

Health Outcome/Bioactivity	Metabolite Response/Effect	Evidence Type	Host and Biospecimen	Data Source	Reference

Microbial Sources

Superkingdom/Kingdom	Phylum	Total species	Hosts and Body Sites	Microbial Links
Eukaryota/Fungi	Ascomycota	1	Human feces; Human saliva	Unknown

Exposure Sources

Other Exposures

Source Type	Data Source	Reference

Host Biospecimen and Location

Host and Biospecimen	Status	Mean	Std	Units	Age	Sex	Health Condition	Data Source	Reference
Human Saliva	Detected and Quantified	0.441	0.133	uM	Adult (>18 years old)	Not Specified	Normal	HMDB	Sugimoto et al. (2013) Physiological and environmental parameters associated with mass spectrometry-based salivary metabolomic profiles.
Human Saliva	Detected and Quantified	0.504	0.126	uM	Adult (>18 years old)	Female	Normal	HMDB	Sugimoto et al. (2013) Physiological and environmental parameters associated with mass spectrometry-based salivary metabolomic profiles.
Human Saliva	Detected and Quantified	0.548	0.153	uM	Adult (>18 years old)	Not Specified	Normal	HMDB	Sugimoto et al. (2013) Physiological and environmental parameters associated with mass spectrometry-based salivary metabolomic profiles.
Human Skeletal muscle	Detected but not Quantified				Not Specified	Not Specified	Normal	HMDB	34986597

External Links

HMDB ID

Not Available

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FooDB ID

Not Available

KNApSAcK ID

Not Available

Chemspider ID

Not Available

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

Not Available

PDB ID

Not Available

ChEBI ID

Not Available

Food Biomarker Ontology

Not Available

CMMC Knowledgebase

Not Available

General References

Jakobsen SN, Hardie DG, Morrice N, Tornqvist HE: 5'-AMP-activated protein kinase phosphorylates IRS-1 on Ser-789 in mouse C2C12 myotubes in response to 5-aminoimidazole-4-carboxamide riboside. J Biol Chem. 2001 Dec 14;276(50):46912-6. doi: 10.1074/jbc.C100483200. Epub 2001 Oct 11. [PubMed:11598104 ]
Koistinen HA, Galuska D, Chibalin AV, Yang J, Zierath JR, Holman GD, Wallberg-Henriksson H: 5-amino-imidazole carboxamide riboside increases glucose transport and cell-surface GLUT4 content in skeletal muscle from subjects with type 2 diabetes. Diabetes. 2003 May;52(5):1066-72. doi: 10.2337/diabetes.52.5.1066. [PubMed:12716734 ]
Koistinen HA, Chibalin AV, Zierath JR: Aberrant p38 mitogen-activated protein kinase signalling in skeletal muscle from Type 2 diabetic patients. Diabetologia. 2003 Oct;46(10):1324-8. doi: 10.1007/s00125-003-1196-3. Epub 2003 Aug 23. [PubMed:12937895 ]

Showing metabocard for Acadesine (MMDBc0033502)

MOL for #<Metabolite:0x00007f9ad8662ec8>

3D MOL for #<Metabolite:0x00007f9ad8662ec8>

3D SDF for #<Metabolite:0x00007f9ad8662ec8>

3D-SDF for #<Metabolite:0x00007f9ad8662ec8>

PDB for #<Metabolite:0x00007f9ad8662ec8>

3D PDB for #<Metabolite:0x00007f9ad8662ec8>

SMILES for #<Metabolite:0x00007f9ad8662ec8>

INCHI for #<Metabolite:0x00007f9ad8662ec8>

Structure for #<Metabolite:0x00007f9ad8662ec8>

3D Structure for #<Metabolite:0x00007f9ad8662ec8>