(3β,6β)-3-Acetoxy-6,19-Dihydroxyurs-12-En-28-Oic Acid

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Formula C32H42O6
IUPAC Name (1r,2r,4as,6as,6br,8r,8ar,10s,12ar)-10-acetyloxy-1,8-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
Molecular Mass 522.672 g·mol−1
Heat of Formation 3181.0 ± 16.7 kJ·mol−1
Dipole Moment 2.30 ± 1.08 D
Volume 464.95 Å 3
Surface Area 381.28 Å 2
HOMO Energy -8.90 ± 0.55 eV
LUMO Energy -2.72 ± eV
Point Group Symmetry C1
InChIKey KBYMABZAFBTCMQ-ZTLMYXHKSA-N
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