Methyl (3β,21Alpha)-3,21-Dihydroxyoleana-11,13(18)-Dien-29-Oate

Molecule SVG Image

Properties Simple | Detailed

Formula C31H48O4
IUPAC Name (3s,4ar,6ar,6bs,8as,10r,11s,14ar,14bs)-11-methoxycarbonyl-4,4,6a,6b,8a,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,14a-dodecahydropicene-3,10-diolate
Molecular Mass 484.710 g·mol−1
Heat of Formation 545.5 ± 16.7 kJ·mol−1
Dipole Moment 3.22 ± 1.08 D
Volume 620.68 Å 3
Surface Area 435.57 Å 2
Point Group Symmetry C1
Synonyms
  • (2s,3r,4as,6ar,6as,6br,8ar,10s,12as)-3,10-dihydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12-dodecahydropicene-2-carboxylic acid methyl ester
  • macedonic acid methyl ester
  • methyl (2s,3r,4as,6ar,6as,6br,8ar,10s,12as)-3,10-dihydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12-dodecahydropicene-2-carboxylate
  • oleana-11,13(18)-dien-29-oic acid, 3,21-dihydroxy-, methyl ester, (3beta,20alpha,21alpha)-
CAS Number(s)
  • 38987-84-7
InChIKey RPZZWTJIBLMBTQ-PLAUNNMJSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O