(25R)-3,7,11,12,15,23-Hexaoxolanost-8-En-26-Oic Acid

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Formula C30H38O8
IUPAC Name (2r,6r)-2-methyl-4-oxo-6-[(5r,10s,13r,14r,17r)-4,4,10,13,14-pentamethyl-3,7,11,12,15-pentaoxo-1,2,5,6,16,17-hexahydrocyclopenta[a]phenanthren-17-yl]heptanoic acid
Molecular Mass 526.618 g·mol−1
Heat of Formation -1440.9 ± 16.7 kJ·mol−1
Dipole Moment 1.30 ± 1.08 D
Volume 632.57 Å 3
Surface Area 470.56 Å 2
HOMO Energy -9.92 ± 0.55 eV
LUMO Energy 1.53 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,6r)-2-methyl-4-oxo-6-[(5r,10s,13r,14r,17r)-4,4,10,13,14-pentamethyl-3,7,11,12,15-pentaoxo-1,2,5,6,16,17-hexahydrocyclopenta[a]phenanthren-17-yl]heptanoic acid
  • (2r,6r)-4-keto-2-methyl-6-[(5r,10s,13r,14r,17r)-3,7,11,12,15-pentaketo-4,4,10,13,14-pentamethyl-1,2,5,6,16,17-hexahydrocyclopenta[a]phenanthren-17-yl]enanthic acid
InChIKey AKWNYHCILPEENZ-YFIDGAHXSA-N
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