CH₃CH₃

Thebaine

Chemistry

44 atoms · Conformer computed and published by PubChem.
Formula
C19H21NO3
Molar mass
311.4 g/mol
IUPAC name
(4R,7aR,12bS)-7,9-dimethoxy-3-methyl-2,4,7a,13-tetrahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline
InChIKey
FQXXSQDCDRQNQE-VMDGZTHMSA-N

Chemistry from PubChem CID 5324289.

Also known as

  • Paramorphine
  • 115-37-7
  • Thebain
  • 3-O-Methyl-oripavin
  • DTXSID7046099
  • 2P9MKG8GX7
  • 4,5alpha-Epoxy-3,6-dimethoxy-17-methyl-6,8-morphinadien
  • (5R,9R,13S)-4,5-Epoxy-3,6-dimethoxy-9alpha-methyl-6,8-morphinadien

Stereoisomers

8 distinct stereoisomers are registered for this structure.

  • Thebaine this area CID 5324289
  • (4S,7aR,12bS)-7,9-dimethoxy-3-methyl-2,4,7a,13-tetrahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline CID 8270
  • (4S,7aS,12bS)-7,9-dimethoxy-3-methyl-2,4,7a,13-tetrahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline CID 667455
  • (4R,7aR,12bR)-7,9-dimethoxy-3-methyl-2,4,7a,13-tetrahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline CID 932843
  • (4R,7aS,12bR)-7,9-dimethoxy-3-methyl-2,4,7a,13-tetrahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline CID 932845
  • (4R,7aS,12bS)-7,9-dimethoxy-3-methyl-2,4,7a,13-tetrahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline CID 5390100
  • (4S,7aR,12bR)-7,9-dimethoxy-3-methyl-2,4,7a,13-tetrahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline CID 5421844
  • (4S,7aS,12bR)-7,9-dimethoxy-3-methyl-2,4,7a,13-tetrahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline CID 5421845
  • Morphinan, 6,7,8,14-tetradehydro-4,5-epoxy-3,6-dimethoxy-17-methyl-, (5alpha)- mixture CID 408120

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