(3Ar,4R,6E,9S,10Z,11Ar)-9-Acetoxy-6,10-Dimethyl-3-Methylene-2-Oxo-2,3,3A,4,5,8,9,11A-Octahydrocyclodeca[B]Furan-4-Yl (2E)-4-Hydroxy-2-(Hydroxymethyl)-2-Butenoate

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Formula C22H28O8
IUPAC Name [(3ar,4r,6e,9s,10z,11ar)-9-acetoxy-6,10-dimethyl-3-methylene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (e)-4-hydroxy-2-(hydroxymethyl)but-2-enoate
Molecular Mass 420.453 g·mol−1
Heat of Formation -1329.2 ± 16.7 kJ·mol−1
Dipole Moment 6.71 ± 1.08 D
Volume 504.1 Å 3
Surface Area 377.31 Å 2
HOMO Energy -9.69 ± 0.55 eV
LUMO Energy -0.54 ± eV
Point Group Symmetry C1
Synonyms
  • (e)-4-hydroxy-2-(hydroxymethyl)but-2-enoic acid [(3ar,4r,6e,9s,10z,11ar)-9-acetoxy-6,10-dimethyl-3-methylene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] ester
  • (e)-4-hydroxy-2-methylol-but-2-enoic acid [(3ar,4r,6e,9s,10z,11ar)-9-acetoxy-2-keto-6,10-dimethyl-3-methylene-3a,4,5,8,9,11a-hexahydrocyclodeca[d]furan-4-yl] ester
  • [(3ar,4r,6e,9s,10z,11ar)-9-acetoxy-6,10-dimethyl-3-methylene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (e)-4-hydroxy-2-(hydroxymethyl)but-2-enoate
  • [(3ar,4r,6e,9s,10z,11ar)-9-acetyloxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (e)-4-hydroxy-2-(hydroxymethyl)but-2-enoate
  • hiyodorilactone a
  • megxp0_000031
InChIKey XYPJAWWDSQFSQA-RTZOPMFNSA-N
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