CFam Chemical Families Database
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You are searching for "CFAMM00025244" in compound.

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CFAM Mol ID CFAMM00025244
Family CFFAD145 HIV protease Inhibitor Indinavir Family
Superfamily CFSAD136 HIV protease Inhibitor Indinavir Superfamily
Class CFCAD134 Class 134
External ID CHEMBL45688 External Source CHEMBL
PubChem CID 44293027 Functional Category Bioactive
Molecule Name (3R)-3-[[(2R)-2-amino-3-naphthalen-1-ylpropanoyl]amino]-4-[[2-[[(2R)-3-(1H-indol-3-yl)-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]-methylamino]-2-oxo-1-phenylethyl]amino]-4-oxobutanoic acid
IUPAC Name (3R)-3-[[(2R)-2-amino-3-naphthalen-1-ylpropanoyl]amino]-4-[[2-[[(2R)-3-(1H-indol-3-yl)-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]-methylamino]-2-oxo-1-phenylethyl]amino]-4-oxobutanoic acid
Synonyms CHEBI:172178
InChi InChI=1S/C41H45N5O7/c1-41(2,3)53-40(52)34(22-28-24-43-32-20-11-10-19-30(28)32)46(4)39(51)36(26-14-6-5-7-15-26)45-38(50)33(23-35(47)48)44-37(49)31(42)21-27-17-12-16-25-13-8-9-18-29(25)27/h5-20,24,31,33-34,36,43H,21-23,42H2,1-4H3,(H,44,49)(H,45,50)(H,47,48)/t31-,33-,34-,36?/m1/s1
Formula C41H45N5O7 Molecular Weight 719.83
Cross Link CHEMBL45688

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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