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Formula C22H28O5
IUPAC Name (8s,9s,10r,11s,13s,14s,17r)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-16-methylene-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-one
Molecular Mass 372.455 g·mol−1
Heat of Formation -771.2 ± 16.7 kJ·mol−1
Dipole Moment 3.77 ± 1.08 D
Volume 447.27 Å 3
Surface Area 347.7 Å 2
HOMO Energy -9.79 ± 0.55 eV
LUMO Energy -0.39 ± eV
Point Group Symmetry C1
Synonyms
  • (8s,9s,10r,11s,13s,14s,17r)-11,17-dihydroxy-17-(2-hydroxy-1-oxoethyl)-10,13-dimethyl-16-methylene-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-one
  • (8s,9s,10r,11s,13s,14s,17r)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-16-methylene-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-one
  • (8s,9s,10r,11s,13s,14s,17r)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-16-methylidene-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-one
  • (8s,9s,10r,11s,13s,14s,17r)-11,17-dihydroxy-17-(2-hydroxyethanoyl)-10,13-dimethyl-16-methylidene-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-one
  • (8s,9s,10r,11s,13s,14s,17r)-17-glycoloyl-11,17-dihydroxy-10,13-dimethyl-16-methylene-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-one
InChIKey WSVOMANDJDYYEY-CWNVBEKCSA-N
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