3-Hydroxychol-2-En-24-Oic Acid

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Formula C24H38O3
IUPAC Name (4r)-4-[(5s,8r,9s,10s,13r,14s,17r)-3-hydroxy-10,13-dimethyl-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1h-cyclopenta[a]phenanthren-17-yl]pentanoic acid
Molecular Mass 374.557 g·mol−1
Heat of Formation -815.9 ± 16.7 kJ·mol−1
Dipole Moment 1.76 ± 1.08 D
Volume 495.32 Å 3
Surface Area 385.96 Å 2
HOMO Energy -8.98 ± 0.55 eV
LUMO Energy 0.99 ± eV
Point Group Symmetry C1
InChIKey HULQGYPWEGNXPA-LZQMWTLUSA-N
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