CFam Chemical Families Database
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You are searching for "CFAMM00275137" in compound.

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CFAM Mol ID CFAMM00275137
Family CFFID2736 Arachidonate 12-lipoxygenase, 12S-type and Arachidonate 15-lipoxygenase Inhibitor (+)-(5s,8s,10s)-20-methoxy-9,15-ene-puupehenol Family
Superfamily CFSID1957 Arachidonate 12-lipoxygenase, 12S-type and Arachidonate 15-lipoxygenase Inhibitor (+)-(5s,8s,10s)-20-methoxy-9,15-ene-puupehenol Superfamily
Class CFCID211 Class 1561
External ID DNC009191 External Source TTD
PubChem CID 44584373 Functional Category Investigative Drug
Molecule Name (+)-(5S,8S,10S)-20-methoxy-9,15-ene-puupehenol
IUPAC Name (4aS,6aS,12bS)-10-methoxy-4,4,12b-trimethyl-2,3,4a,5,6,6a-hexahydro-1H-benzo[a]xanthen-9-ol
Synonyms CHEBI:604972;DNC009191;(+)-(5S,8S,10S)-20-methoxy-9,15-ene-puupehenol
InChi InChI=1S/C21H28O3/c1-20(2)8-5-9-21(3)14-10-13-11-18(23-4)15(22)12-17(13)24-16(14)6-7-19(20)21/h10-12,16,19,22H,5-9H2,1-4H3/t16-,19-,21+/m0/s1
InChiKey VKVKDSPLZVAEMG-NBHGPNQESA-N
Formula C21H28O3 Molecular Weight 328.45
Cross Link CHEMBL456949
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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