3A-Dihydrocadambine

Molecule SVG Image

Properties Simple | Detailed

Formula C27H34N2O10
IUPAC Name 3a-dihydrocadambine
Molecular Mass 546.566 g·mol−1
Heat of Formation -1584.2 ± 16.7 kJ·mol−1
Dipole Moment 3.35 ± 1.08 D
Volume 611.6 Å 3
Surface Area 476.35 Å 2
HOMO Energy -8.38 ± 0.55 eV
LUMO Energy 2.89 ± eV
Point Group Symmetry C1
Synonyms
  • 3-alpha-dihydrocadambine
  • 3-dihydrocadambine
  • d-homooxayohimban-16-carboxylic acid, 16,17-didehydro-19-(beta-d-glucopyranosyloxy)-21-hydroxy-, methyl ester, (19-alpha,20-alpha,21-beta)-
CAS Number(s)
  • 54483-84-0
InChIKey HNZGKRAKJFZQAY-SBAWYOAKSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N