A-Canadine

Molecule SVG Image

Properties Simple | Detailed

Formula C20H21NO4
IUPAC Name a-canadine
Molecular Mass 339.385 g·mol−1
Heat of Formation -362.7 ± 16.7 kJ·mol−1
Dipole Moment 1.68 ± 1.08 D
Volume 389.7 Å 3
Surface Area 340.99 Å 2
HOMO Energy -8.60 ± 0.55 eV
LUMO Energy 0.02 ± eV
Point Group Symmetry C1
Synonyms
  • (-)-canadine
  • (13as)-5,8,13,13a-tetrahydro-9,10-dimethoxy-6h-benzo[g]-1,3-benzodioxolo[5,6-a]quinolizine
  • (13as)-9,10-dimethoxy-5,8,13,13a-tetrahydro-2h,6h-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinoline
  • (s)-canadine
  • (s)-tetrahydroberberine
  • 13a-alpha-berbine, 9,10-dimethoxy-2,3-(methylenedioxy)-
  • 5,6,13,13a-tetrahydro-9,10-dimethoxy-2,3-(methylenedioxy)-8h-dibenzo(a,g)quinolizine
  • 6h-benzo(g)-1,3-benzodioxolo(5,6-a)quinolizine, 5,8,13,13a-tetrahydro-9,10-dimethoxy-, (s)-
  • 6h-benzo[g]-1,3-benzodioxolo[5,6-a]quinolizine, 5,8,13,13a-tetrahydro-9,10-dimethoxy-, (13as)-
  • 9,10-dimethoxy-2,3-(methylenedioxy)berbine
  • canadine l-form
  • tetrahydroberberine
CAS Number(s)
  • 5096-57-1
InChIKey VZTUIEROBZXUFA-INIZCTEOSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N