(1R,14S)-20,26-Dimethoxy-15,31-Dimethyl-8,24-Dioxa-15,31-Diazaheptacyclo[23.6.2.2~9,12~.1~3,7~.1~14,18~.0~22,34~.0~28,32~]Heptatriaconta-3(37),4,6,9,11,18(34),19,21,25,27,32,35-Dodecaene-6,21-Diol

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Formula C37H40N2O6
IUPAC Name (1r,14s)-20,26-dimethoxy-15,31-dimethyl-8,24-dioxa-15,31-diazaheptacyclo[23.6.2.2 9,12 .1 3,7 .1 14,18 .0 22,34 .0 28,32 ]heptatriaconta-3(37),4,6,9,11,18(34),19,21,25,27,32,35-dodecaene-6,21-diol
Molecular Mass 608.723 g·mol−1
Heat of Formation -669.1 ± 16.7 kJ·mol−1
Dipole Moment 5.54 ± 1.08 D
Volume 711.54 Å 3
Surface Area 487.91 Å 2
HOMO Energy -8.59 ± 0.55 eV
LUMO Energy 2.75 ± eV
Point Group Symmetry C1
Synonyms
  • 2h-1,24:12,15-dietheno-6,10-metheno-16h-pyrido[2',3':17,18][1,10]dioxacycloeicosino[2,3,4-ij]isoquinolin-9-ol, 3,4,4a,5,16a,17,18,19-octahydro-21,22,26-trimethoxy-4,17-dimethyl-, (4ar,16as)-
  • 6,6',7-trimethoxy-2,2'-dimethyl-oxyacanthan-12'-ol
  • n-methylocoteamine
  • n-methylsepeerine
  • oxyacanthan-12'-ol, 6,6',7'-trimethoxy-2,2'-dimethyl-
  • oxyacanthan-12'-ol, 6,6',7-trimethoxy-2,2'-dimethyl-
  • oxycanthine
  • vinetine
CAS Number(s)
  • 28639-25-0
  • 62018-86-4
InChIKey KFOTVHQUFWAKNY-IHLOFXLRSA-N
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