Trilobolide

Molecule SVG Image

Properties Simple | Detailed

Formula C27H38O10
IUPAC Name [(3s,3ar,4s,6s,6as,8r,9bs)-6-acetoxy-3,3a-dihydroxy-3,6,9-trimethyl-8-[(z)-2-methylbut-2-enoyl]oxy-2-oxo-4,5,6a,7,8,9b-hexahydroazuleno[4,5-b]furan-4-yl] (2s)-2-methylbutanoate
Molecular Mass 522.585 g·mol−1
Heat of Formation 117.3 ± 16.7 kJ·mol−1
Dipole Moment 4.92 ± 1.08 D
Volume 606.31 Å 3
Surface Area 459.97 Å 2
Point Group Symmetry C1
Synonyms
  • (z)-2-methylbut-2-enoic acid [(3s,3ar,4s,6s,6as,8r,9bs)-6-acetoxy-3,3a-dihydroxy-2-keto-3,6,9-trimethyl-4-[(2s)-2-methylbutanoyl]oxy-4,5,6a,7,8,9b-hexahydroazuleno[4,5-b]furan-8-yl] ester
  • (z)-2-methylbut-2-enoic acid [(3s,3ar,4s,6s,6as,8r,9bs)-6-acetoxy-3,3a-dihydroxy-3,6,9-trimethyl-4-[(2s)-2-methyl-1-oxobutoxy]-2-oxo-4,5,6a,7,8,9b-hexahydroazuleno[4,5-b]furan-8-yl] ester
  • [(3s,3ar,4s,6s,6as,8r,9bs)-6-acetoxy-3,3a-dihydroxy-3,6,9-trimethyl-4-[(2s)-2-methylbutanoyl]oxy-2-oxo-4,5,6a,7,8,9b-hexahydroazuleno[4,5-b]furan-8-yl] (z)-2-methylbut-2-enoate
  • [(3s,3ar,4s,6s,6as,8r,9bs)-6-acetyloxy-3,3a-dihydroxy-3,6,9-trimethyl-4-[(2s)-2-methylbutanoyl]oxy-2-oxo-4,5,6a,7,8,9b-hexahydroazuleno[4,5-b]furan-8-yl] (z)-2-methylbut-2-enoate
CAS Number(s)
  • 50657-07-3
InChIKey FIAZIVNRHQWTPY-QAAPNFDWSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O