1-O-[(2α,3Beta)-2,3,19-Trihydroxy-23,28-Dioxours-12-En-28-Yl]-Beta-D-Glucopyranose

Molecule SVG Image

Properties Simple | Detailed

Formula C36H56O11
IUPAC Name (2s,3r,4s,5s,6r)-2-[(1r,2r,4as,6ar,6as,6br,8ar,9s,10r,11r,12ar,14bs)-1,2,6a,6b,9,12a-hexamethyl-1,10,11-trioxido-9-(oxomethyl)-5,6,6a,7,8,8a,10,12,13,14b-decahydropicene-2,11-diide-4a-carbonyl]oxy-6-(oxidomethyl)tetrahydropyran-2,3,4,5,6-pentaide-3,4,5-triolate
Molecular Mass 664.823 g·mol−1
Heat of Formation 973.7 ± 16.7 kJ·mol−1
Dipole Moment 9.03 ± 1.08 D
Volume 699.83 Å 3
Surface Area 516.07 Å 2
Point Group Symmetry C1
Synonyms
  • (1r,2r,4as,6ar,6as,6br,8ar,9s,10r,11r,12ar,14bs)-9-formyl-1,10,11-trihydroxy-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid [(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl] ester
  • (1r,2r,4as,6ar,6as,6br,8ar,9s,10r,11r,12ar,14bs)-9-formyl-1,10,11-trihydroxy-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid [(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl] ester
  • [(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1r,2r,4as,6ar,6as,6br,8ar,9s,10r,11r,12ar,14bs)-1,10,11-trihydroxy-9-methanoyl-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
  • [(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1r,2r,4as,6ar,6as,6br,8ar,9s,10r,11r,12ar,14bs)-9-formyl-1,10,11-trihydroxy-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
  • [(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl] (1r,2r,4as,6ar,6as,6br,8ar,9s,10r,11r,12ar,14bs)-9-formyl-1,10,11-trihydroxy-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
  • glucosyl 23-formyl-2,3,19-trihydroxyurs-12-en-28-oate
  • pinfaensin
  • urs-12-en-28-oic acid, 2,3,19-trihydroxy-23-oxo-, beta-d-glucopyranosyl ester, (2alpha,3beta,4alpha)-
CAS Number(s)
  • 158848-20-5
InChIKey YZANFWDKMDESHV-JVJIQXRHSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O