CFam Chemical Families Database
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You are searching for "CFAMM00321734" in compound.

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CFAM Mol ID CFAMM00321734
Family CFFBM1302 Thromboxane A2 receptor ligand 11-[2-[(3-methylthiophene-2-carbonyl)amino]ethylsulfanyl]-6,11-dihydrobenzo[c][1]benzoxepine-2-carboxylic acid family
Superfamily CFSBM744 Thyrotropin receptor and Endothelin-1 receptor Binder Superfamily
Class CFCID651 Class 2001
External ID CHEMBL114260 External Source CHEMBL
PubChem CID 10029290 Functional Category Bioactive
Molecule Name SureCN9375501
IUPAC Name 11-[2-[(3,4,5-trimethoxybenzoyl)amino]ethylsulfanyl]-6,11-dihydrobenzo[c][1]benzoxepine-2-carboxylic acid
Synonyms CHEBI:288243
InChi InChI=1S/C27H27NO7S/c1-32-22-13-18(14-23(33-2)24(22)34-3)26(29)28-10-11-36-25-19-7-5-4-6-17(19)15-35-21-9-8-16(27(30)31)12-20(21)25/h4-9,12-14,25H,10-11,15H2,1-3H3,(H,28,29)(H,30,31)
InChiKey MBJVOGHLUUNQDV-UHFFFAOYSA-N
Formula C27H27NO7S Molecular Weight 509.57
Cross Link CHEMBL114260
Structure

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).
 

Last update by

 
2014.08.29
 

 

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Professor in Department of Pharmacy
National University of Singapore, Singapore


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