1-O-[(2α,3Beta,5Xi,9Xi,18Xi,19α)-2,3,19,24-Tetrahydroxy-28-Oxoolean-12-En-28-Yl]-Beta-D-Glucopyranose

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Properties Simple | Detailed

Formula C36H18O11
IUPAC Name 1-o-[(2alpha,3beta,5xi,9xi,18xi,19alpha)-2,3,19,24-tetrahydroxy-28-oxoolean-12-en-28-yl]-β-d-glucopyranose
Molecular Mass 626.522 g·mol−1
Heat of Formation 2928.9 ± 16.7 kJ·mol−1
Dipole Moment 11.15 ± 1.08 D
Volume 678.77 Å 3
Surface Area 497.02 Å 2
HOMO Energy -7.64 ± 0.55 eV
LUMO Energy -2.46 ± eV
Point Group Symmetry C1
InChIKey CMZFNIMQBCBHEX-WYZQMZRLSA-N
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