CFam Chemical Families Database
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You are searching for "CFAMM00555525" in compound.

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CFAM Mol ID CFAMM00555525
Family CFFNP905 NP (e)-4-methoxy-6,6-dimethyl-5-(2-oxo-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-en-1-yl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium Iodide Family
Superfamily CFSNP220 1-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-9-yl)ethanone NP 1-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-9-yl)ethanone and 5-[3-[(3-tert-butyl-6,7,8,9-tetrahydrodibenzofuran-2-yl)oxy]prop-1-ynyl]-4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline NP ZINC20113915 Superfamily
Class CFCAD621 Class 621
External ID ZINC20112010 External Source ZINC
PubChem CID 6352084 Functional Category Natural Product
Molecule Name (E)-1-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-6,10-dimethylundeca-5,9-dien-2-one
IUPAC Name (5E)-1-[(5S)-4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-6,10-dimethylundeca-5,9-dien-2-one
Synonyms ZINC20112010;(5E)-1-[(5S)-4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-6,10-dimethylundeca-5,9-dien-2-one
InChi InChI=1S/C25H35NO4/c1-17(2)8-6-9-18(3)10-7-11-20(27)15-21-23-19(12-13-26(21)4)14-22-24(25(23)28-5)30-16-29-22/h8,10,14,21H,6-7,9,11-13,15-16H2,1-5H3/b18-10+/t21-/m0/s1
InChiKey LSLGUUOXZXVOPO-KYRPUADMSA-N
Formula C25H35NO4 Molecular Weight 413.55
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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Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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