(3β,5Xi,18Alpha)-3-[(3-Carboxypropanoyl)Oxy]-11-Oxoolean-12-En-29-Oic Acid

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Formula C34H50O7
IUPAC Name (2r,4as,6ar,6as,6br,8as,10s,12as,14br)-10-(3-carboxypropanoyloxy)-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 570.757 g·mol−1
Heat of Formation -1579.4 ± 16.7 kJ·mol−1
Dipole Moment 3.73 ± 1.08 D
Volume 707.76 Å 3
Surface Area 522.93 Å 2
HOMO Energy -9.62 ± 0.55 eV
LUMO Energy 2.98 ± eV
Point Group Symmetry C1
InChIKey OBZHEBDUNPOCJG-BLYQTLGGSA-N
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