CFAM Mol ID	CFAMM00330398
Family	CFFBM2099 Pol polyprotein inhibitor benzyl (2S)-2-[[[(2S)-3-[cyclopentylmethyl-(4-methoxyphenyl)sulfonylamino]-2-hydroxypropyl]-(2-phenylethyl)carbamoyl]amino]-3-methylbutanoate family
Superfamily	CFSBM867 Pol polyprotein and Collagenase 3 Binder Superfamily
Class	CFCBM337 Class 3387
External ID	CHEMBL187776	External Source	CHEMBL
PubChem CID	5279199	Functional Category	Bioactive
Molecule Name	AC1NQUJX
IUPAC Name	tert-butyl N-[(2S,3R)-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-phenoxyamino]-1-phenylbutan-2-yl]carbamate
Synonyms	N-alkoxysulfonamide analog 7;Carbamic acid, [(1S,2R)-2-hydroxy-3-[[(4-methoxyphenyl)sulfonyl]phenoxyamino]-1-(phenylmethyl)propyl]-, 1,1-dimethylethyl ester;tert-butyl N-[(2S,3R)-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-phenoxyamino]-1-phenylbutan-2-yl]carbamate
InChi	InChI=1S/C28H34N2O7S/c1-28(2,3)36-27(32)29-25(19-21-11-7-5-8-12-21)26(31)20-30(37-23-13-9-6-10-14-23)38(33,34)24-17-15-22(35-4)16-18-24/h5-18,25-26,31H,19-20H2,1-4H3,(H,29,32)/t25-,26+/m0/s1
InChiKey	GCANREIOWKPDFF-IZZNHLLZSA-N
Formula	C28H34N2O7S	Molecular Weight	542.64
Cross Link	CHEMBL187776
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

48716 visits since 2014 .........

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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