CFam Chemical Families Database
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You are searching for "CFAMM00393078" in compound.

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CFAM Mol ID CFAMM00393078
Family CFFBM9113 Beta-secretase 1 inhibitor (2S)-2-[(3S)-3-acetamido-3-butan-2-yl-2-oxopyrrolidin-1-yl]-N-[(1R,2S)-3-(3,5-difluorophenyl)-1-[(2R,4R)-4-[(4-fluorophenyl)methylsulfonyl]pyrrolidin-2-yl]-1-hydroxypropan-2-yl]-4-phenylbutanamide family
Superfamily CFSBM1 Renin and Pol polyprotein Binder Superfamily
Class CFCAD168 Class 168
External ID 54557134 External Source PubChem
PubChem CID 54557134 Functional Category Patent Compound
Molecule Name SureCN10443629
IUPAC Name (2S)-2-[acetyl-[(2S)-2-amino-3-phenylpropanoyl]amino]-2-(6-cyano-1,1-dioxo-2,3-dihydro-1-benzothiophen-3-yl)-N-[(2S,3S)-1-cyclohexyl-3-hydroxy-5-(2-methylpropylamino)-5-oxopentan-2-yl]-4-methylpentanamide
InChi InChI=1S/C41H57N5O7S/c1-26(2)22-41(33-25-54(52,53)37-20-31(23-42)16-17-32(33)37,46(28(5)47)39(50)34(43)18-29-12-8-6-9-13-29)40(51)45-35(19-30-14-10-7-11-15-30)36(48)21-38(49)44-24-27(3)4/h6,8-9,12-13,16-17,20,26-27,30,33-36,48H,7,10-11,14-15,18-19,21-22,24-25,43H2,1-5H3,(H,44,49)(H,45,51)/t33?,34-,35-,36-,41-/m0/s1
Formula C41H57N5O7S Molecular Weight 763.99
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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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