(+)-Gomisin K3

Molecule SVG Image

Properties Simple | Detailed

Formula C23H30O6
IUPAC Name (9s,10r)-4,5,14,15,16-pentamethoxy-9,10-dimethyl-tricyclo[10.4.0.02,7]hexadeca-1(16),2,4,6,12,14-hexaen-3-ol
Molecular Mass 402.481 g·mol−1
Heat of Formation -891.9 ± 16.7 kJ·mol−1
Dipole Moment 2.62 ± 1.08 D
Volume 487.76 Å 3
Surface Area 381.76 Å 2
HOMO Energy -8.36 ± 0.55 eV
LUMO Energy 0.00 ± eV
Point Group Symmetry C1
Synonyms
  • dibenzo(a,c)cycloocten-1-ol, 5,6,7,8-tetrahydro-2,3,10,11,12-pentamethoxy-6,7-dimethyl-, stereoisomer
  • dibenzo[a,c]cycloocten-1-ol, 5,6,7,8-tetrahydro-2,3,10,11,12-pentamethoxy-6,7-dimethyl-, (6s,7r)-
  • schisanhenol
CAS Number(s)
  • 69363-14-0
InChIKey FYSHYFPJBONYCQ-QWHCGFSZSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O