CFam Chemical Families Database
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You are searching for "CFAMM00435554" in compound.

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Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00435554
Family CFFBM15683 3-oxo-5-alpha-steroid 4-dehydrogenase 1 and 3-oxo-5-alpha-steroid 4-dehydrogenase 2 inhibitor SureCN9033274 family
Superfamily CFSBM4 Substance-P receptor and Leukotriene B4 receptor 1 Binder Superfamily
Class CFCID1099 Class 2449
External ID CHEMBL97093 External Source CHEMBL
PubChem CID 44329671 Functional Category Bioactive
Molecule Name 4-[2-[[(E)-3-[1-(2,2-dimethylpropyl)indol-5-yl]but-2-enoyl]amino]phenoxy]butanoic acid;toluene
IUPAC Name 4-[2-[[(E)-3-[1-(2,2-dimethylpropyl)indol-5-yl]but-2-enoyl]amino]phenoxy]butanoic acid;toluene
Synonyms CHEBI:259866
InChi InChI=1S/C27H32N2O4.C7H8/c1-19(20-11-12-23-21(17-20)13-14-29(23)18-27(2,3)4)16-25(30)28-22-8-5-6-9-24(22)33-15-7-10-26(31)32;1-7-5-3-2-4-6-7/h5-6,8-9,11-14,16-17H,7,10,15,18H2,1-4H3,(H,28,30)(H,31,32);2-6H,1H3/b19-16+;
Formula C27H32N2O4.C7H8 Molecular Weight 540.69
Cross Link CHEMBL97093

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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