CFam Chemical Families Database
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You are searching for "CFAMM00220100" in compound.

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CFAM Mol ID CFAMM00220100
Family CFFID855 Cathepsin F and Cruzipain Inhibitor WRR-99 Family
Superfamily CFSID699 Cathepsin F and Cruzipain Inhibitor WRR-99 Superfamily
Class CFCID492 Class 1842
External ID CHEMBL443493 External Source CHEMBL
PubChem CID 23647290 Functional Category Bioactive
Molecule Name SureCN8270494
IUPAC Name but-3-enyl N-[(2S)-1-[[(2S)-1-[[(4S,5S,7R)-8-[[(2S)-1-(benzylamino)-3-methyl-1-oxobutan-2-yl]amino]-5-hydroxy-2,7-dimethyl-8-oxooctan-4-yl]amino]-1,4-dioxo-4-(prop-2-enylamino)butan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]carbamate
Synonyms amide-urethane derived inhibitor 12b
InChi InChI=1S/C39H62N6O8/c1-10-12-19-53-39(52)45-34(26(7)8)38(51)43-30(22-32(47)40-18-11-2)36(49)42-29(20-24(3)4)31(46)21-27(9)35(48)44-33(25(5)6)37(50)41-23-28-16-14-13-15-17-28/h10-11,13-17,24-27,29-31,33-34,46H,1-2,12,18-23H2,3-9H3,(H,40,47)(H,41,50)(H,42,49)(H,43,51)(H,44,48)(H,45,52)/t27-,29+,30+,31+,33+,34+/m1/s1
Formula C39H62N6O8 Molecular Weight 742.94
Cross Link CHEMBL443493

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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