(3As,6S,6Ar,9As,9Br)-6A-Hydroxy-6,9A-Dimethyl-3-Methylene-3,3A,4,5,6,6A,9A,9B-Octahydroazuleno[4,5-B]Furan-2,9-Dione

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Properties Simple | Detailed

Formula C15H18O4
IUPAC Name (3as,6s,6ar,9as,9br)-6a-hydroxy-6,9a-dimethyl-3-methylene-4,5,6,9b-tetrahydro-3ah-azuleno[8,7-b]furan-2,9-dione
Molecular Mass 262.301 g·mol−1
Heat of Formation -566.6 ± 16.7 kJ·mol−1
Dipole Moment 8.56 ± 1.08 D
Volume 308.3 Å 3
Surface Area 255.13 Å 2
HOMO Energy -9.89 ± 0.55 eV
LUMO Energy -0.38 ± eV
Point Group Symmetry C1
Synonyms
  • (3as,6s,6ar,9as,9br)-6a-hydroxy-6,9a-dimethyl-3-methylene-4,5,6,9b-tetrahydro-3ah-azuleno[7,8-d]furan-2,9-dione
  • (3as,6s,6ar,9as,9br)-6a-hydroxy-6,9a-dimethyl-3-methylene-4,5,6,9b-tetrahydro-3ah-azuleno[7,8-d]furan-2,9-quinone
  • (3as,6s,6ar,9as,9br)-6a-hydroxy-6,9a-dimethyl-3-methylidene-4,5,6,9b-tetrahydro-3ah-azuleno[7,8-d]furan-2,9-dione
  • (3as-(3aalpha,6beta,6aalpha,9abeta,9balpha))-3,3a,4,5,6,6a,9a,9b-octahydro-6a-hydroxy-6,9a-dimethyl-3-methyleneazuleno (4,5-b)furan-2,9-dione
  • 10-alpha-h-ambrosa-2,11(13)-dien-12-oic acid, 1,6-beta-dihydroxy-4-oxo-, gamma-l
  • 10-alpha-h-ambrosa-2,11(13)-dien-12-oic acid, 1,6-beta-dihydroxy-4-oxo-, gamma-lactone
  • 10alphah-ambrosa-2,11(13)-dien-12-oic acid, 1,6beta-dihydroxy-4-oxo-, gamma-lactone (8ci)
  • 1beta,10alphah-ambrosa-2,11(13)-dien-12-oic acid, 1,6beta-dihydroxy-4-oxo-, gamma-lactone
  • azuleno(4,5-b)furan-2,9-dione, 3,3a,4,5,6,6a,9a,9b-octahydro-6a-hydroxy-6,9a-dimethyl-3-methylene-, (3as,6s,6ar,9as,9br)-
  • azuleno(4,5-b)furan-2,9-dione, 3,3a,4,5,6,6a,9a,9b-octahydro-6a-hydroxy-6,9a-dimethyl-3-methylene-, (3as-(3aalpha,6beta,6aalpha,9abeta,9balpha))- (9ci)
  • azuleno(4,5-b)furan-2,9-dione, 3,3a,4,5,6,6a,9a,9b-octahydro-6a-hydroxy-6,9a-dimethyl-3-methylene-, (3as-(3aalpha,6beta,6abeta,9abeta,9balpha))-
  • epiparthenin
  • hymenin
CAS Number(s)
  • 20555-04-8
InChIKey LLQCRTZROWMVOL-DYDIJXKYSA-N
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