Cerberin

Molecule SVG Image

Properties Simple | Detailed

Formula C32H48O9
IUPAC Name (2s,3s,4r,5s,6s)-5-acetyloxy-6-[[(3s,5r,8r,9s,10s,13r,14s,17r)-14-hydroxy-10,13-dimethyl-17-(5-oxo-2h-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-methoxy-2-methyl-tetrahydropyran-2,3,4,5,6-pentaid-3-olate
Molecular Mass 576.718 g·mol−1
Heat of Formation -112.0 ± 16.7 kJ·mol−1
Dipole Moment 3.26 ± 1.08 D
Volume 682.42 Å 3
Surface Area 509.47 Å 2
Point Group Symmetry C1
Synonyms
  • [(2r,3s,4r,5s,6s)-5-hydroxy-2-[[(3s,5r,8r,9s,10s,13r,14s,17r)-14-hydroxy-10,13-dimethyl-17-(5-oxo-2h-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-methoxy-6-methyl-oxan-3-yl] ethanoate
  • [(2r,3s,4r,5s,6s)-5-hydroxy-2-[[(3s,5r,8r,9s,10s,13r,14s,17r)-14-hydroxy-10,13-dimethyl-17-(5-oxo-2h-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-methoxy-6-methyl-tetrahydropyran-3-yl] acetate
  • [(2r,3s,4r,5s,6s)-5-hydroxy-2-[[(3s,5r,8r,9s,10s,13r,14s,17r)-14-hydroxy-10,13-dimethyl-17-(5-oxo-2h-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-methoxy-6-methyloxan-3-yl] acetate
  • acetic acid [(2r,3s,4r,5s,6s)-5-hydroxy-2-[[(3s,5r,8r,9s,10s,13r,14s,17r)-14-hydroxy-10,13-dimethyl-17-(5-oxo-2h-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-methoxy-6-methyl-3-tetrahydropyranyl] ester
  • acetic acid [(2r,3s,4r,5s,6s)-5-hydroxy-2-[[(3s,5r,8r,9s,10s,13r,14s,17r)-14-hydroxy-17-(5-keto-2h-furan-3-yl)-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-methoxy-6-methyl-tetrahydropyran-3-yl] ester
InChIKey UYQMTWMXBKEHJQ-IVHDSYOHSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O