CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00542660" 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 CFAMM00542660
Family CFFHM1663 Lactones Metabolite xi-Tetrahydro-3-pentyl-2H-pyran-2-one Family
Superfamily CFSHM509 Benzopyrans Metabolite Octahydro-2H-1-benzopyran-2-one and Lactones Metabolite xi-Tetrahydro-3-pentyl-2H-pyran-2-one Superfamily
Class CFCHM310 Class 7395
External ID ZINC12297127 External Source ZINC
PubChem CID 42507474 Functional Category Natural Product
Molecule Name ethyl (3S)-3-[(4R)-2,2-dimethyloxan-4-yl]-6-methylheptanoate
IUPAC Name ethyl (3S)-3-[(4R)-2,2-dimethyloxan-4-yl]-6-methylheptanoate
InChi InChI=1S/C17H32O3/c1-6-19-16(18)11-14(8-7-13(2)3)15-9-10-20-17(4,5)12-15/h13-15H,6-12H2,1-5H3/t14-,15+/m0/s1
Formula C17H32O3 Molecular Weight 284.43
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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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