(3α)-3-Hydroxyurs-12-En-23-Oic Acid

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Formula C30H48O3
IUPAC Name (3r,4s,4ar,6ar,6bs,8ar,11r,12s,12ar,14ar,14br)-3-hydroxy-4,6a,6b,8a,11,12,14b-heptamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1h-picene-4-carboxylic acid
Molecular Mass 456.700 g·mol−1
Heat of Formation -877.5 ± 16.7 kJ·mol−1
Dipole Moment 3.17 ± 1.08 D
Volume 587.56 Å 3
Surface Area 422.04 Å 2
HOMO Energy -8.97 ± 0.55 eV
LUMO Energy 1.35 ± eV
Point Group Symmetry C1
InChIKey NBGQZFQREPIKMG-SKPJQDMCSA-N
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