CFam Chemical Families Database
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You are searching for "CFAMM00243369" in compound.

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CFAM Mol ID CFAMM00243369
Family CFFID1566 Substance-K receptor Ligand MEN-14933 Family
Superfamily CFSID1220 Substance-K receptor Ligand MEN-14933 Superfamily
Class CFCCD537 Class 1350
External ID ZINC04043709 External Source ZINC
PubChem CID 7082943 Functional Category Natural Product
Molecule Name 1-(((1R,4aS)-7-isopropyl-1,4a-dimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthren-1-yl)methyl)-3-(4-methoxyphenyl)urea
IUPAC Name 1-[[(1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl]methyl]-3-(4-methoxyphenyl)urea
Synonyms ZINC04043709;1-[[(1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl]methyl]-3-(4-methoxyphenyl)urea
InChi InChI=1S/C28H38N2O2/c1-19(2)20-7-13-24-21(17-20)8-14-25-27(3,15-6-16-28(24,25)4)18-29-26(31)30-22-9-11-23(32-5)12-10-22/h7,9-13,17,19,25H,6,8,14-16,18H2,1-5H3,(H2,29,30,31)/t25-,27-,28+/m0/s1
InChiKey SZCUAQITTPFEBX-RZDMPUFOSA-N
Formula C28H38N2O2 Molecular Weight 434.61
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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