(5Xi,9Xi,16α,18α,21α,22Beta)-16,21,22,23,28-Pentahydroxyolean-12-En-3-Yl Beta-D-Glucopyranosiduronic Acid

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Formula C36H16O12
IUPAC Name (5xi,9xi,16alpha,18alpha,21alpha,22beta)-16,21,22,23,28-pentahydroxyolean-12-en-3-yl β-d-glucopyranosiduronic acid
Molecular Mass 640.505 g·mol−1
Heat of Formation 1825.3 ± 16.7 kJ·mol−1
Dipole Moment 9.79 ± 1.08 D
Volume 611.07 Å 3
Surface Area 510.07 Å 2
HOMO Energy -8.92 ± 0.55 eV
LUMO Energy -3.86 ± eV
Point Group Symmetry C1
InChIKey NXUZSZLFZAMZLC-JZDZKGAASA-N
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