methyl (2S,4aR,6aR,7R,9S,10aS,10bR)-2-(furan-3-yl)-9-heptanoyloxy-6a,10b-dimethyl-4,10-dioxo-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f]isochromene-7-carboxylate
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methyl (2S,4aR,6aR,7R,9S,10aS,10bR)-2-(furan-3-yl)-9-heptanoyloxy-6a,10b-dimethyl-4,10-dioxo-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f]isochromene-7-carboxylate
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CAS No:
689295-72-5
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Formula:
C28H38O8
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Chemical Name:
methyl (2S,4aR,6aR,7R,9S,10aS,10bR)-2-(furan-3-yl)-9-heptanoyloxy-6a,10b-dimethyl-4,10-dioxo-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f]isochromene-7-carboxylate
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Synonyms:
divinorin heptanoate;689295-72-5;Salvinorin heptanoate;divinorinyl-2-heptanoate;salvinorinyl-2-heptanoate;DTXSID20349342;2H-naphtho[2,1-c]pyran-7-carboxylic acid, 2-(3-furanyl)dodecahydro-6a,10b-dimethyl-4,10-dioxo-9-[(1-oxoheptyl)oxy]-, methyl ester, (2S,4aR,6aR,7R,9S,10aS,10bR)-;2H-Naphtho[2,1-c]pyran-7-carboxylic acid, 2-(3-furanyl)dodecahydro-6a,10b-dimethyl-4,10-dioxo-9-[(1-oxoheptyl)oxy]-, methyl ester, (2S,4aR,6aR,7R,9S,10aS,10bR)- (9CI)
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CAS No:
methyl (2S,4aR,6aR,7R,9S,10aS,10bR)-2-(furan-3-yl)-9-heptanoyloxy-6a,10b-dimethyl-4,10-dioxo-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f]isochromene-7-carboxylate Basic Attributes
502.6 g/mol
502.25666817 g/mol
DTXSID20349342
Computed Properties
Molecular Weight:502.6
XLogP3:5
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:10
Exact Mass:502.25666817
Monoisotopic Mass:502.25666817
Topological Polar Surface Area:109
Heavy Atom Count:36
Complexity:870
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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