CFam Chemical Families Database
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You are searching for "CFAMM00291158" in compound.

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CFAM Mol ID CFAMM00291158
Family CFFID3431 Angiotensin-converting enzyme Inhibitor N-carboxymethyl-n-cyclopentyl-phthalamic Acid Family
Superfamily CFSID2371 Angiotensin-converting enzyme Inhibitor N-carboxymethyl-n-cyclopentyl-phthalamic Acid Superfamily
Class CFCID435 Class 1785
External ID ZINC04027721 External Source ZINC
PubChem CID 7077599 Functional Category Natural Product
Molecule Name AC1OEC85
IUPAC Name 2-[[(3R)-3-[(4S)-2,2-dimethyloxan-4-yl]-3-phenylpropyl]carbamoyl]benzoate
Synonyms ZINC04027721;2-[[(3R)-3-[(4S)-2,2-dimethyloxan-4-yl]-3-phenylpropyl]carbamoyl]benzoate
InChi InChI=1S/C24H29NO4/c1-24(2)16-18(13-15-29-24)19(17-8-4-3-5-9-17)12-14-25-22(26)20-10-6-7-11-21(20)23(27)28/h3-11,18-19H,12-16H2,1-2H3,(H,25,26)(H,27,28)/p-1/t18-,19-/m0/s1
InChiKey KPPXEWKTJDJEAL-OALUTQOASA-M
Formula C24H28NO4- Molecular Weight 394.48
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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Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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