CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00536050" in compound.

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Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00536050
Family CFFHM631 Prenol Lipids Metabolite alpha-Irone Family
Superfamily CFSHM364 Prenol Lipids Metabolite alpha-Irone Superfamily
Class CFCHM227 Class 7312
External ID 20441051 External Source PubChem
PubChem CID 20441051 Functional Category Patent Compound
Molecule Name AGN-PC-02TMDX
IUPAC Name 2,4-ditert-butyl-10-cyclohexylspiro[5.5]undeca-1,4,9-trien-3-one
Synonyms SureCN11057393;2,4-ditert-butyl-10-cyclohexylspiro[5.5]undeca-1,4,9-trien-3-one
InChi InChI=1S/C25H38O/c1-23(2,3)20-16-25(17-21(22(20)26)24(4,5)6)14-10-13-19(15-25)18-11-8-7-9-12-18/h13,16-18H,7-12,14-15H2,1-6H3
Formula C25H38O Molecular Weight 354.57
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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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