Labda-8(20),14-Dien-13-Ol, (13S)-

Molecule SVG Image

Properties Simple | Detailed

Formula C20H34O
IUPAC Name (3s)-5-[(1s,4as,8as)-5,5,8a-trimethyl-2-methylene-decalin-1-yl]-3-methyl-pent-1-en-3-ol
Molecular Mass 290.483 g·mol−1
Heat of Formation -329.2 ± 16.7 kJ·mol−1
Dipole Moment 2.31 ± 1.08 D
Volume 411.37 Å 3
Surface Area 324.96 Å 2
HOMO Energy -9.53 ± 0.55 eV
LUMO Energy 3.93 ± eV
Point Group Symmetry C1
Synonyms
  • (3s)-3-methyl-5-[(1s,4as,8as)-5,5,8a-trimethyl-2-methylidenedecahydronaphthalen-1-yl]pent-1-en-3-ol
  • (3s)-5-[(1s,4as,8as)-5,5,8a-trimethyl-2-methylene-1-decalinyl]-3-methylpent-1-en-3-ol
  • (3s)-5-[(1s,4as,8as)-5,5,8a-trimethyl-2-methylene-decalin-1-yl]-3-methyl-pent-1-en-3-ol
  • (3s)-5-[(1s,4as,8as)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1h-naphthalen-1-yl]-3-methyl-pent-1-en-3-ol
  • (3s)-5-[(1s,4as,8as)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1h-naphthalen-1-yl]-3-methylpent-1-en-3-ol
InChIKey CECREIRZLPLYDM-RAUXBKROSA-N
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