(3β)-3-({[(1S,2R)-2-Carboxycyclohexyl]Carbonyl}Oxy)-11-Oxoolean-12-En-30-Oic Acid

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Formula C38H56O7
IUPAC Name 10-(2-carboxycyclohexanecarbonyl)oxy-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxo-3,4,5,6,6a,7,8,8a,10,11,12,14b-dodecahydro-1h-picene-2-carboxylic acid
Molecular Mass 624.847 g·mol−1
Heat of Formation 4594.7 ± 16.7 kJ·mol−1
Dipole Moment 1.97 ± 1.08 D
Volume 698.79 Å 3
Surface Area 515.72 Å 2
HOMO Energy -8.66 ± 0.55 eV
LUMO Energy -0.16 ± eV
Point Group Symmetry C1
InChIKey IPIHZIYZLLMCRF-APMXPKBPSA-N
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