6-Oxo-6H-Indolo[3,2,1-De][1,5]Naphthyridin-5-Yl 6-O-β-D-Glucopyranosyl-β-D-Glucopyranoside

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Properties Simple | Detailed

Formula C26H28N2O12+
IUPAC Name 6-oxo-6h-indolo[3,2,1-de][1,5]naphthyridin-5-yl 6-o-β-d-glucopyranosyl-β-d-glucopyranoside
Molecular Mass 560.507 g·mol−1
Heat of Formation 481.6 ± 16.7 kJ·mol−1
Dipole Moment 1.15 ± 1.08 D
Volume 590.44 Å 3
Surface Area 464.38 Å 2
HOMO Energy -6.88 ± 0.55 eV
LUMO Energy -5.46 ± eV
Point Group Symmetry C1
Synonyms
  • 5-o-glucopyranosyl-1-6-glucopyranosylcanthin-6-one
  • 6h-indolo(3,2,1-de)(1,5)naphthyridin-6-one, 5-((6-o-beta-d-glucopyranosyl-beta-d-glucopyranosyl)oxy)-
  • bruceolline b
CAS Number(s)
  • 159194-91-9
InChIKey VNELTEBGMWTQED-NXEOTYAVSA-N
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