CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00414870" in compound.

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CFAM Mol ID CFAMM00414870
Family CFFBM12291 Thromboxane-A synthase inhibitor Imitrodast family
Superfamily CFSBM5726 Thromboxane-A synthase Binder Superfamily
Class CFCBM1586 Class 4636
External ID 53882488 External Source PubChem
PubChem CID 53882488 Functional Category Patent Compound
Molecule Name
IUPAC Name 2-[2-[(R)-imidazol-1-yl(phenyl)methyl]-4,5-dihydro-1-benzothiophen-6-yl]-4-[methyl-[3-methyl-1-[(2-methylpropan-2-yl)oxy]-1-oxobutan-2-yl]amino]but-2-enoic acid
InChi InChI=1S/C32H39N3O4S/c1-21(2)28(31(38)39-32(3,4)5)34(6)16-14-25(30(36)37)23-12-13-24-19-27(40-26(24)18-23)29(35-17-15-33-20-35)22-10-8-7-9-11-22/h7-11,14-15,17-21,28-29H,12-13,16H2,1-6H3,(H,36,37)/t28?,29-/m1/s1
Formula C32H39N3O4S Molecular Weight 561.73
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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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