CFam Chemical Families Database
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You are searching for "CFAMM00141954" in compound.

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CFAM Mol ID CFAMM00141954
Family CFFCD191 DNA topoisomerase 2-beta Inhibitor TOP-53 Family
Superfamily CFSCD174 DNA topoisomerase 2-beta Binder Superfamily 2
Class CFCAD746 Class 746
External ID CHEMBL431651 External Source CHEMBL
PubChem CID 178103 Functional Category Bioactive
Molecule Name enrasentan
IUPAC Name (1S,2R,3S)-1-(1,3-benzodioxol-5-yl)-3-[2-(2-hydroxyethoxy)-4-methoxyphenyl]-5-propoxy-2,3-dihydro-1H-indene-2-carboxylic acid
Synonyms SB-217242;SB 217242;UNII-QG16H8A6ZH;SureCN1649828;CHEBI:279627;AC1L4363;PDSP2_001716;167256-08-8;3-(2-(2-hydroxyeth-1-yloxy)-4-methoxyphenyl)-1-(3,4-methylenedioxyphenyl)-5-(prop-1-yloxy)indan-2-carboxylic acid
InChi InChI=1S/C29H30O8/c1-3-11-34-19-6-7-20-22(14-19)27(21-8-5-18(33-2)15-24(21)35-12-10-30)28(29(31)32)26(20)17-4-9-23-25(13-17)37-16-36-23/h4-9,13-15,26-28,30H,3,10-12,16H2,1-2H3,(H,31,32)/t26-,27+,28+/m0/s1
Formula C29H30O8 Molecular Weight 506.54
Cross Link CHEMBL431651

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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