CFam Chemical Families Database
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You are searching for "CFAMM00559360" in compound.

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CFAM Mol ID CFAMM00559360
Family CFFNP1330 Putative NP ZINC04084382 Family
Superfamily CFSNP341 3-[[4-(4-chlorophenyl)-1,2,3,6-tetrahydropyridin-1-ium-1-yl]methyl]-8a-methylspiro[3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f][1]benzofuran-5,2'-oxirane]-2-one NP ZINC35363872 and octahydrobenzo[f][1]benzofuran-2-one NP ZINC12866668 Superfamily
Class CFCBM348 Class 3398
External ID ZINC02119306 External Source ZINC
PubChem CID 1774149 Functional Category Natural Product
Molecule Name AC1LXFM5
IUPAC Name [(3R,3aR,8aR,9aR)-5,8a-dimethyl-2-oxo-3,3a,7,8,9,9a-hexahydrobenzo[f][1]benzofuran-3-yl]methyl-[(1S)-1-phenylethyl]azanium
Synonyms ZINC02119306;[(3R,3aR,8aR,9aR)-5,8a-dimethyl-2-oxo-3,3a,7,8,9,9a-hexahydrobenzo[f][1]benzofuran-3-yl]methyl-[(1S)-1-phenylethyl]azanium
InChi InChI=1S/C23H29NO2/c1-15-8-7-11-23(3)13-21-18(12-20(15)23)19(22(25)26-21)14-24-16(2)17-9-5-4-6-10-17/h4-6,8-10,12,16,18-19,21,24H,7,11,13-14H2,1-3H3/p+1/t16-,18+,19-,21+,23+/m0/s1
Formula C23H30NO2+ Molecular Weight 352.49
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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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