7-Hydroxy-3-Oxocholest-4-En-26-Oic Acid

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Formula C27H42O4
IUPAC Name (2r,6r)-6-[(7r,8s,9s,10r,13r,14r,17s)-7-hydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-methyl-heptanoic acid
Molecular Mass 430.620 g·mol−1
Heat of Formation -995.9 ± 16.7 kJ·mol−1
Dipole Moment 5.17 ± 1.08 D
Volume 564.4 Å 3
Surface Area 435.06 Å 2
HOMO Energy -9.77 ± 0.55 eV
LUMO Energy -0.02 ± eV
Point Group Symmetry C1
InChIKey SATGKQGFUDXGAX-FPOIHZDZSA-N
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Elements H C O