(3α,4α,8α,9Beta,13α,14Beta,16Beta,17E)-3-Hydroxy-4,14-Dimethyl-11-Oxo-16-(Propionyloxy)-18-Norcholesta-17,24-Dien-21-Oic Acid

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Formula C31H46O6
IUPAC Name (2e)-2-[(10s,14r)-3-hydroxy-4,10,14-trimethyl-11-oxo-16-propanoyloxy-2,3,4,5,6,7,8,9,12,13,15,16-dodecahydro-1h-cyclopenta[a]phenanthren-17-ylidene]-6-methyl-hept-5-enoic acid
Molecular Mass 514.693 g·mol−1
Heat of Formation 3293.9 ± 16.7 kJ·mol−1
Dipole Moment 7.29 ± 1.08 D
Volume 511.63 Å 3
Surface Area 431.05 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy -2.32 ± eV
Point Group Symmetry C1
InChIKey ISLLRJYHCSQDTN-NKBXWAJESA-N
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