Sinomenine

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Properties Simple | Detailed

Formula C19H23NO4
IUPAC Name (1r,9s,10s)-3-hydroxy-4,12-dimethoxy-17-methyl-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5,11-tetraen-13-one
Molecular Mass 329.390 g·mol−1
Heat of Formation -503.6 ± 16.7 kJ·mol−1
Dipole Moment 5.01 ± 1.08 D
Volume 389.82 Å 3
Surface Area 313.44 Å 2
HOMO Energy -8.81 ± 0.55 eV
LUMO Energy 0.02 ± eV
Point Group Symmetry C1
Synonyms
  • (9alpha,13alpha,14alpha)-7,8-didehydro-4-hydroxy-3,7-dimethoxy-17-methylmorphinan-6-one
  • 7,8-didehydro-4-hydroxy-3,7-dimethoxy-17-methyl-9-alpha,13-alpha,14-alpha-morphinan-6-one
  • 9-alpha,13-alpha,14-alpha-morphinan-6-one, 7,8-didehydro-4-hydroxy-3,7-dimethoxy-17-methyl-
  • bcbcmap01_000195
  • coculine
  • cucoline
  • kukoline
  • sabianine a
  • smp1_000273
InChIKey INYYVPJSBIVGPH-QHRIQVFBSA-N
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