Manoalide

Molecule SVG Image

Properties Simple | Detailed

Formula C25H36O5
IUPAC Name (2r)-2-hydroxy-3-[(2r,6r)-6-hydroxy-5-[(e)-4-methyl-6-(2,6,6-trimethylcyclohexen-1-yl)hex-3-enyl]-3,6-dihydro-2h-pyran-2-yl]-2h-furan-5-one
Molecular Mass 416.550 g·mol−1
Heat of Formation -915.7 ± 16.7 kJ·mol−1
Dipole Moment 4.35 ± 1.08 D
Volume 539.93 Å 3
Surface Area 405.43 Å 2
HOMO Energy -8.63 ± 0.55 eV
LUMO Energy -0.95 ± eV
Point Group Symmetry C1
Synonyms
  • (5r)-5-hydroxy-4-[(2r,6r)-6-hydroxy-5-[(e)-4-methyl-6-(2,6,6-trimethyl-1-cyclohexenyl)hex-3-enyl]-3,6-dihydro-2h-pyran-2-yl]-5h-furan-2-one
  • 2(5h)-furanone, 4-((2r,6r)-3,6-dihydro-6-hydroxy-5-((3e)-4-methyl-6-(2,6,6-trimethyl-1-cyclohexen-1-yl)-3-hexenyl)-2h-pyran-2-yl)-5-hydroxy-, (5r)-
  • 2(5h)-furanone, 4-(3,6-dihydro-6-hydroxy-5-(4-methyl-6-(2,6,6-trimethyl-1-cyclohexen-1-yl)-3-hexenyl)-2h-pyran-2-yl)-5-hydroxy-
CAS Number(s)
  • 75088-80-1
InChIKey FGJIDQWRRLDGDB-CPIXEKRISA-N
QR Code Generate QR Code
Links PubChem Wikipedia ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O