CFam Chemical Families Database
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You are searching for "CFAMM00108027" in compound.

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CFAM Mol ID CFAMM00108027
Family CFFAD852 26S proteasome Inhibitor Bortezomib Family
Superfamily CFSAD714 26S proteasome Inhibitor Bortezomib Superfamily
Class CFCAD507 Class 507
External ID DNC001157 External Source TTD
PubChem CID 93860 Functional Category Investigative Drug
Molecule Name PS-341
IUPAC Name [(1S)-3-methyl-1-[[(2R)-3-phenyl-2-(pyrazine-2-carbonylamino)propanoyl]amino]butyl]boronic acid
Synonyms PS 341 (pharmaceutical);LDP 341;MLN-341;MG 341;NSC 681239;Pyz-Phe-boroLeu;Velcade (TN);S1013_Selleck;Boronic acid, ((1R)-3-methyl-1-(((2S)-1-oxo-3-phenyl-2-((pyrazinylcarbonyl)amino)propyl)amino)butyl)-;Boronic acid, (3-methyl-1-((1-oxo-3-phenyl-2-((pyrazinylcarbonyl)amino)propyl)amino)butyl)-, (S-(R*,S*))-
InChi InChI=1S/C19H25BN4O4/c1-13(2)10-17(20(27)28)24-18(25)15(11-14-6-4-3-5-7-14)23-19(26)16-12-21-8-9-22-16/h3-9,12-13,15,17,27-28H,10-11H2,1-2H3,(H,23,26)(H,24,25)/t15-,17-/m1/s1
InChiKey GXJABQQUPOEUTA-NVXWUHKLSA-N
Formula C19H25BN4O4 Molecular Weight 384.24
Cross Link
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
 

 

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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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