Stoloniferone E

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Formula C28H44O3
IUPAC Name (6r,8s,9s,10r,11r,13r,14s,17r)-6,11-dihydroxy-10,13-dimethyl-17-[(1r,4s)-1,4,5-trimethylhexyl]-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-1-one
Molecular Mass 428.647 g·mol−1
Heat of Formation -742.8 ± 16.7 kJ·mol−1
Dipole Moment 2.31 ± 1.08 D
Volume 568.36 Å 3
Surface Area 432.92 Å 2
HOMO Energy -9.75 ± 0.55 eV
LUMO Energy -0.88 ± eV
Point Group Symmetry C1
Synonyms
  • (6r,8s,9s,10r,11r,13r,14s,17r)-17-[(2r,5s)-5,6-dimethylheptan-2-yl]-6,11-dihydroxy-10,13-dimethyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-1-one
  • (6r,8s,9s,10r,11r,13r,14s,17r)-6,11-dihydroxy-10,13-dimethyl-17-[(1r,4s)-1,4,5-trimethylhexyl]-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-1-one
InChIKey RYMHLKHGLSCOPD-BONNHHEPSA-N
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