CFam Chemical Families Database
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You are searching for "CFAMM00257208" in compound.

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CFAM Mol ID CFAMM00257208
Family CFFID2016 Cathepsin B and Cathepsin S Inhibitor Cbz-ile-leu-ala-leuvsme Family
Superfamily CFSID698 Cruzipain and Cathepsin S Binder Superfamily
Class CFCCD382 Class 1195
External ID CHEMBL132566 External Source CHEMBL
PubChem CID 44353603 Functional Category Bioactive
Molecule Name benzyl N-[1-[[4-[2-[5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]ethylamino]-3,4-dioxo-1-phenylbutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate
IUPAC Name benzyl N-[1-[[4-[2-[5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]ethylamino]-3,4-dioxo-1-phenylbutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate
Synonyms CHEBI:317891
InChi InChI=1S/C36H48N6O7S/c1-23(2)19-27(41-36(48)49-21-25-13-7-4-8-14-25)33(45)39-26(20-24-11-5-3-6-12-24)32(44)34(46)38-18-17-37-30(43)16-10-9-15-29-31-28(22-50-29)40-35(47)42-31/h3-8,11-14,23,26-29,31H,9-10,15-22H2,1-2H3,(H,37,43)(H,38,46)(H,39,45)(H,41,48)(H2,40,42,47)/t26?,27?,28-,29-,31-/m0/s1
Formula C36H48N6O7S Molecular Weight 708.87
Cross Link CHEMBL132566

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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