CH₃CH₃

Salvinorin B

Chemistry

54 atoms · Conformer computed and published by PubChem.
Formula
C21H26O7
Molar mass
390.4 g/mol
IUPAC name
methyl (2S,4aR,6aR,7R,9S,10aS,10bR)-2-(furan-3-yl)-9-hydroxy-6a,10b-dimethyl-4,10-dioxo-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f]isochromene-7-carboxylate
InChIKey
BLTMVAIOAAGYAR-CEFSSPBYSA-N

Chemistry from PubChem CID 11440685.

Also known as

  • 92545-30-7
  • 6HNB6FRT7X
  • methyl (2S,4aR,6aR,7R,9S,10aS,10bR)-2-(furan-3-yl)-9-hydroxy-6a,10b-dimethyl-4,10-dioxo-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f]isochromene-7-carboxylate
  • DTXSID50465988
  • methyl (2S,4aR,6aR,7R,9S,10aS,10bR)-2-(furan-3-yl)-9-hydroxy-6a,10b-dimethyl-4,10-dioxo-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo(f)isochromene-7-carboxylate
  • RefChem:181048
  • DTXCID80416807
  • Divinorin B

Stereoisomers

6 distinct stereoisomers are registered for this structure.

  • Salvinorin B this area CID 11440685
  • (2S,4aS,6aR,7R,9S,10aS,10bR)-9-(hydroxy)-2-(3-furanyl)dodecahydro-6a,10b-dimethyl-4,10-dioxo-2H-naphtho[2,1-c]pyran-7-carboxylic acid methyl ester CID 11395172
  • methyl (2S,4aR,6aR,7R,9R,10aS,10bR)-2-(furan-3-yl)-9-hydroxy-6a,10b-dimethyl-4,10-dioxo-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f]isochromene-7-carboxylate CID 24858447
  • methyl (2R,4aR,6aR,7R,9R,10aS,10bR)-2-(furan-3-yl)-9-hydroxy-6a,10b-dimethyl-4,10-dioxo-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f]isochromene-7-carboxylate CID 46831607
  • 12-Epi-Salvinorin B CID 46832153
  • methyl (2S,4aR,6aS,7R,9S,10aS,10bR)-2-(furan-3-yl)-9-hydroxy-6a,10b-dimethyl-4,10-dioxo-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f]isochromene-7-carboxylate CID 124919025
  • Sanguinarine (RG) mixture CID 72830360

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