(3Ar,4As,5R,7R,8As,9R,10Ar)-5,7-Dihydroxy-4A,9-Dimethyl-3-Methylenedecahydrofuro[2',3':5,6]Cyclohepta[1,2-C]Pyran-2(3H)-One

Molecule SVG Image

Properties Simple | Detailed

Formula C15H22O5
IUPAC Name (1r,3r,4as,5r,6ar,9ar,10as)-1,3-dihydroxy-5,10a-dimethyl-9-methylene-3,4,4a,5,6,6a,9a,10-octahydro-1h-furo[3,4]cyclohepta[5,7-d]pyran-8-one
Molecular Mass 282.332 g·mol−1
Heat of Formation -954.9 ± 16.7 kJ·mol−1
Dipole Moment 4.27 ± 1.08 D
Volume 334.86 Å 3
Surface Area 275.48 Å 2
HOMO Energy -10.41 ± 0.55 eV
LUMO Energy -0.17 ± eV
Point Group Symmetry C1
Synonyms
  • furo(2',3':5,6)cyclohepta(1,2-c)pyran-2(3h)-one, decahydro-5,7-dihydroxy-4a,9-dimethyl-3-methylene-, (3ar,4as,5r,7r,8ar,9r,10ar)-
  • furo(2',3':5,6)cyclohepta(1,2-c)pyran-2(3h)-one, decahydro-5,7-dihydroxy-4a,9-dimethyl-3-methylene-, (3ar-(3a-alpha,4a-beta,5-alpha,7-beta,8a-alpha,9-alpha,10a-alpha))-
  • hymenovin
  • hymenoxon
  • hymenoxone
CAS Number(s)
  • 57377-32-9
InChIKey PYINVOHSOZSEPB-DKGLCQEFSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O