Dihydro-14-Hydroxy-4-O-Methyl-6B-Thebainol

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Properties Simple | Detailed

Formula C19H27NO4
IUPAC Name (1r,9r,10s,13r)-3,4-dimethoxy-17-methyl-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene-10,13-diol
Molecular Mass 333.422 g·mol−1
Heat of Formation -674.9 ± 16.7 kJ·mol−1
Dipole Moment 3.78 ± 1.08 D
Volume 398.62 Å 3
Surface Area 313.99 Å 2
HOMO Energy -8.95 ± 0.55 eV
LUMO Energy 0.12 ± eV
Point Group Symmetry C1
Synonyms
  • 14-hydroxy-6-beta-thebainol 4-methyl ether
  • 14-hydroxydihydro-6-beta-thebainol 4-methyl ether
  • 3,4-dimethoxy-17-methylmorphinan-6-beta,14-diol
  • 3,4-dimethoxy-17-methylmorphinan-6beta,14-diol
  • 6-beta,14-dihydroxy-3,4-dimethoxy-n-methylmorphinan
  • d01496
  • dea no. 9335
  • dihydro-14-hydroxy-4-o-methyl-6-beta-thebainol
  • dihydro-14-hydroxy-6-beta-thebainol 4 methyl ester
  • drotebanol
  • drotebanol [ban:dcf:inn]
  • metebanyl
  • morphinan, 6-beta,14-dihydroxy-3,4-dimethoxy-n-methyl-
  • morphinan-6-beta,14-diol, 3,4-dimethoxy-17-methyl-
  • oxymetebanol
  • oxymethebanol
  • ram-326
CAS Number(s)
  • 3176-03-2
InChIKey LCAHPIFLPICNRW-SVYNMNNPSA-N
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