CFam Chemical Families Database
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You are searching for "CFAMM00381321" in compound.

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CFAM Mol ID CFAMM00381321
Family CFFBM7575 Interstitial collagenase and Matrilysin inhibitor (2S,3R)-N,2-dihydroxy-N'-[(2S)-1-(1H-indol-3-yl)-3,3-dimethyl-1-oxobutan-2-yl]-3-(2-methylpropyl)butanediamide family
Superfamily CFSBM665 Interstitial collagenase and Matrilysin Binder Superfamily
Class CFCAD295 Class 295
External ID CHEMBL171865 External Source CHEMBL
PubChem CID 44381592 Functional Category Bioactive
Molecule Name (3S,4S)-N-[(2S)-1-(3-acetylindol-1-yl)-1-oxopropan-2-yl]-4-[[(2S)-2-[(2-amino-2-methylbutanoyl)amino]-3-methylbutanoyl]amino]-3-hydroxy-6-methylheptanamide
IUPAC Name (3S,4S)-N-[(2S)-1-(3-acetylindol-1-yl)-1-oxopropan-2-yl]-4-[[(2S)-2-[(2-amino-2-methylbutanoyl)amino]-3-methylbutanoyl]amino]-3-hydroxy-6-methylheptanamide
Synonyms CHEBI:382686
InChi InChI=1S/C31H47N5O6/c1-9-31(8,32)30(42)35-27(18(4)5)28(40)34-23(14-17(2)3)25(38)15-26(39)33-19(6)29(41)36-16-22(20(7)37)21-12-10-11-13-24(21)36/h10-13,16-19,23,25,27,38H,9,14-15,32H2,1-8H3,(H,33,39)(H,34,40)(H,35,42)/t19-,23-,25-,27-,31?/m0/s1
Formula C31H47N5O6 Molecular Weight 585.73
Cross Link CHEMBL171865

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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