CFam Chemical Families Database
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You are searching for "CFAMM00570805" in compound.

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CFAM Mol ID CFAMM00570805
Family CFFNP3521 Putative NP ZINC02930279 Family
Superfamily CFSID1145 Carboxypeptidase B2 Inhibitor Dl-benzylsuccinic Acid Superfamily
Class CFCCD94 Class 907
External ID ZINC00367118 External Source ZINC
PubChem CID 6948999 Functional Category Natural Product
Molecule Name AC1OCRYR
IUPAC Name 2-[(2R,4R)-2-ethyl-2-methyl-4-(4-methylphenyl)oxan-4-yl]acetate
Synonyms ZINC00367118;2-[(2R,4R)-2-ethyl-2-methyl-4-(4-methylphenyl)oxan-4-yl]acetate
InChi InChI=1S/C17H24O3/c1-4-16(3)12-17(9-10-20-16,11-15(18)19)14-7-5-13(2)6-8-14/h5-8H,4,9-12H2,1-3H3,(H,18,19)/p-1/t16-,17+/m1/s1
InChiKey JIZLCLRKAOQRQP-SJORKVTESA-M
Formula C17H23O3- Molecular Weight 275.36
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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