CFam Chemical Families Database
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You are searching for "CFAMM00450832" in compound.

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CFAM Mol ID CFAMM00450832
Family CFFBM19161 Adenosine receptor A2a and Adenosine receptor A2b ligand (3R,4S,5R)-2-[6-amino-2-[(2E)-2-(cyclohexylmethylidene)hydrazinyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol family
Superfamily CFSBM5406 Adenosine receptor A2a and Adenosine receptor A2b Binder Superfamily
Class CFCAD172 Class 172
External ID CHEMBL610443 External Source CHEMBL
PubChem CID 46876581 Functional Category Bioactive
Molecule Name (3R,4S,5R)-2-[6-amino-2-[(2E)-2-(3-bicyclo[2.2.1]hept-2-enylmethylidene)hydrazinyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
IUPAC Name (3R,4S,5R)-2-[6-amino-2-[(2E)-2-(3-bicyclo[2.2.1]hept-2-enylmethylidene)hydrazinyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
InChi InChI=1S/C18H23N7O4/c19-15-12-16(25(7-20-12)17-14(28)13(27)11(6-26)29-17)23-18(22-15)24-21-5-10-4-8-1-2-9(10)3-8/h4-5,7-9,11,13-14,17,26-28H,1-3,6H2,(H3,19,22,23,24)/b21-5+/t8?,9?,11-,13-,14-,17?/m1/s1
Formula C18H23N7O4 Molecular Weight 401.42
Cross Link CHEMBL610443

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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National University of Singapore, Singapore

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