CFam Chemical Families Database
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You are searching for "CFAMM00215087" in compound.

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CFAM Mol ID CFAMM00215087
Family CFFID603 Poly [ADP-ribose] polymerase 1 Inhibitor EB-47 Family
Superfamily CFSCD331 Adenosine receptor A3 and Pigment epithelium-derived factor Binder Superfamily
Class CFCAD652 Class 652
External ID CHEMBL2042302 External Source CHEMBL
PubChem CID 57384288 Functional Category Bioactive
Molecule Name (2S,3S,4R,5R)-5-[6-amino-2-[2-[4-[(3,5-ditert-butyl-4-hydroxybenzoyl)amino]phenyl]ethylamino]purin-9-yl]-N-ethyl-3,4-dihydroxyoxolane-2-carboxamide
IUPAC Name (2S,3S,4R,5R)-5-[6-amino-2-[2-[4-[(3,5-ditert-butyl-4-hydroxybenzoyl)amino]phenyl]ethylamino]purin-9-yl]-N-ethyl-3,4-dihydroxyoxolane-2-carboxamide
InChi InChI=1S/C35H46N8O6/c1-8-37-31(48)27-25(45)26(46)32(49-27)43-17-39-23-28(36)41-33(42-29(23)43)38-14-13-18-9-11-20(12-10-18)40-30(47)19-15-21(34(2,3)4)24(44)22(16-19)35(5,6)7/h9-12,15-17,25-27,32,44-46H,8,13-14H2,1-7H3,(H,37,48)(H,40,47)(H3,36,38,41,42)/t25-,26+,27-,32+/m0/s1
Formula C35H46N8O6 Molecular Weight 674.79
Cross Link CHEMBL2042302

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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