CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00539457" in compound.

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CFAM Mol ID CFAMM00539457
Family CFFHM1148 Prenol Lipids Metabolite (E)-5,8-Megastigmadien-4-one Family
Superfamily CFSHM668 Prenol Lipids Metabolite (E)-5,8-Megastigmadien-4-one Superfamily
Class CFCID1196 Class 2546
External ID 20441073 External Source PubChem
PubChem CID 20441073 Functional Category Patent Compound
Molecule Name AGN-PC-02TMEJ
IUPAC Name 2,4-ditert-butyl-9,10-dipentylspiro[5.5]undeca-1,4,9-trien-3-one
Synonyms SureCN11049252;2,4-ditert-butyl-9,10-dipentylspiro[5.5]undeca-1,4,9-trien-3-one
InChi InChI=1S/C29H48O/c1-9-11-13-15-22-17-18-29(19-23(22)16-14-12-10-2)20-24(27(3,4)5)26(30)25(21-29)28(6,7)8/h20-21H,9-19H2,1-8H3
Formula C29H48O Molecular Weight 412.69
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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).

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National University of Singapore, Singapore

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