Chinensiolide A

Molecule SVG Image

Properties Simple | Detailed

Formula C15H18O4
IUPAC Name (3as,6r,6ar,9ar,9bs)-6-hydroxy-6-methyl-3,9-dimethylene-4,5,6a,7,9a,9b-hexahydro-3ah-azuleno[4,5-b]furan-2,8-dione
Molecular Mass 262.301 g·mol−1
Heat of Formation -609.1 ± 16.7 kJ·mol−1
Dipole Moment 7.03 ± 1.08 D
Volume 312.52 Å 3
Surface Area 263.36 Å 2
HOMO Energy -10.12 ± 0.55 eV
LUMO Energy -0.26 ± eV
Point Group Symmetry C1
Synonyms
  • (3as,6r,6ar,9ar,9bs)-6-hydroxy-6-methyl-3,9-dimethylene-4,5,6a,7,9a,9b-hexahydro-3ah-azuleno[5,4-d]furan-2,8-dione
  • (3as,6r,6ar,9ar,9bs)-6-hydroxy-6-methyl-3,9-dimethylene-4,5,6a,7,9a,9b-hexahydro-3ah-azuleno[5,4-d]furan-2,8-quinone
  • (3as,6r,6ar,9ar,9bs)-6-hydroxy-6-methyl-3,9-dimethylidene-4,5,6a,7,9a,9b-hexahydro-3ah-azuleno[5,4-d]furan-2,8-dione
  • 10alpha-hydroxy-3-oxoguaia-4(15),11(13)-dieno-12,6-lactone
  • 6-hydroxy-6-methyl-3,9-dimethylene-octahydro-azuleno[4,5-b]furan-2,8-dione
  • azuleno[4,5-b]furan-2,8(3h,4h)-dione, octahydro-6-hydroxy-6-methyl-3,9-bis(methylene)-, (3as,6r,6ar,9ar,9bs)-
  • rel-(3ar,6s,6as,9as,9br)-6-hydroxy-6-methyl-3,9-bis(methylene)octahydroazuleno[4,5-b]furan-2,8(3h,4h)-dione
InChIKey ZFIYHRXIURBIFJ-WXDRJKLISA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O