CFam Chemical Families Database
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You are searching for "CFAMM00554895" in compound.

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CFAM Mol ID CFAMM00554895
Family CFFNP836 Putative NP ZINC04041531 Family
Superfamily CFSNP292 Putative NP ZINC04041531 and NP ZINC08790569 Superfamily
Class CFCAD746 Class 746
External ID ZINC12659790 External Source ZINC
PubChem CID 7078247 Functional Category Natural Product
Molecule Name AC1OED29
IUPAC Name [(3R,3aR,4aR,8aR,9aR)-8a-methyl-5-methylidene-2-oxo-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f][1]benzofuran-3-yl]methyl-[2-(3,4-dimethoxyphenyl)ethyl]azanium
Synonyms ZINC12659790;[(3R,3aR,4aR,8aR,9aR)-8a-methyl-5-methylidene-2-oxo-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f][1]benzofuran-3-yl]methyl-[2-(3,4-dimethoxyphenyl)ethyl]azanium
InChi InChI=1S/C25H35NO4/c1-16-6-5-10-25(2)14-23-18(13-20(16)25)19(24(27)30-23)15-26-11-9-17-7-8-21(28-3)22(12-17)29-4/h7-8,12,18-20,23,26H,1,5-6,9-11,13-15H2,2-4H3/p+1/t18-,19+,20-,23-,25-/m1/s1
Formula C25H36NO4+ Molecular Weight 414.56
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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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