CFam Chemical Families Database
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You are searching for "CFAMM00178058" in compound.

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CFAM Mol ID CFAMM00178058
Family CFFID65 Flovagatran family
Superfamily CFSID50 Cathepsin B and Cathepsin L1 Binder Superfamily
Class CFCAD610 Class 610
External ID CHEMBL27164 External Source CHEMBL
PubChem CID 44275948 Functional Category Bioactive
Molecule Name 2-[[2-benzyl-3-[hydroxy-[(1R)-2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]propanoyl]amino]propanoic acid
IUPAC Name 2-[[2-benzyl-3-[hydroxy-[(1R)-2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]propanoyl]amino]propanoic acid
Synonyms CHEBI:134962
InChi InChI=1S/C29H33N2O7P/c1-21(28(33)34)30-27(32)25(17-22-11-5-2-6-12-22)20-39(36,37)26(18-23-13-7-3-8-14-23)31-29(35)38-19-24-15-9-4-10-16-24/h2-16,21,25-26H,17-20H2,1H3,(H,30,32)(H,31,35)(H,33,34)(H,36,37)/t21?,25?,26-/m1/s1
InChiKey WTLVZPORKGWOHD-HFYIDVTOSA-N
Formula C29H33N2O7P Molecular Weight 552.56
Cross Link CHEMBL27164
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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