CFam Chemical Families Database
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You are searching for "CFAMM00177883" in compound.

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CFAM Mol ID CFAMM00177883
Family CFFID65 Flovagatran family
Superfamily CFSID50 Cathepsin B and Cathepsin L1 Binder Superfamily
Class CFCAD610 Class 610
External ID CHEMBL383238 External Source CHEMBL
PubChem CID 44409368 Functional Category Bioactive
Molecule Name benzyl (3S)-3-[[(3S)-1,2-dioxo-1-[[(1R)-1-phenylethyl]amino]heptan-3-yl]carbamoyloxy]-4,4-dimethyl-2-oxopyrrolidine-1-carboxylate
IUPAC Name benzyl (3S)-3-[[(3S)-1,2-dioxo-1-[[(1R)-1-phenylethyl]amino]heptan-3-yl]carbamoyloxy]-4,4-dimethyl-2-oxopyrrolidine-1-carboxylate
Synonyms CHEBI:442679
InChi InChI=1S/C30H37N3O7/c1-5-6-17-23(24(34)26(35)31-20(2)22-15-11-8-12-16-22)32-28(37)40-25-27(36)33(19-30(25,3)4)29(38)39-18-21-13-9-7-10-14-21/h7-16,20,23,25H,5-6,17-19H2,1-4H3,(H,31,35)(H,32,37)/t20-,23+,25-/m1/s1
InChiKey WPXHFEMBMPUNEA-JHMXWDHMSA-N
Formula C30H37N3O7 Molecular Weight 551.63
Cross Link CHEMBL383238
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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Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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