CFam Chemical Families Database
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You are searching for "CFAMM00186225" in compound.

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CFAM Mol ID CFAMM00186225
Family CFFID272 3-hydroxy-3-methylglutaryl-coenzyme A reductase and Alcohol dehydrogenase [NADP(+)] Inhibitor 2'-monophosphoadenosine 5'-diphosphoribose Family
Superfamily CFSID222 Adenosine receptor A2a and Adenosine receptor A1 Binder Superfamily
Class CFCAD652 Class 652
External ID CHEMBL254869 External Source CHEMBL
PubChem CID 123756 Functional Category Bioactive
IUPAC Name [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy-[hydroxy(phosphonooxy)phosphoryl]oxyphosphoryl]oxymethyl]oxolan-3-yl] 2-(methylamino)benzoate
Synonyms 21H,23H-Porphine-2,18-dipropanoic acid, 3,7,13,17-tetramethyl-;Adenosine 5'-(tetrahydrogen triphosphate), 3'-(2-(methylamino)benzoate);85287-56-5;AC1L3X8M;AC1Q6S3I;3'-O-N-Methylanthraniloyl-ATP;CHEBI:519147;CHEMID085287565;3'-O-(N-methylanthraniloyl) ATP
InChi InChI=1S/C18H23N6O14P3/c1-20-10-5-3-2-4-9(10)18(26)36-14-11(6-34-40(30,31)38-41(32,33)37-39(27,28)29)35-17(13(14)25)24-8-23-12-15(19)21-7-22-16(12)24/h2-5,7-8,11,13-14,17,20,25H,6H2,1H3,(H,30,31)(H,32,33)(H2,19,21,22)(H2,27,28,29)/t11-,13-,14-,17-/m1/s1
Formula C18H23N6O14P3 Molecular Weight 640.33
Cross Link CHEMBL254869

Statistics of CFAM Database

CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.

How to cite our database

C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).

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