16-Acetoxy-3-[(6-Deoxy-3-O-Methylhexopyranosyl)Oxy]-14-Hydroxycard-20(22)-Enolide

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Formula C32H48O10
IUPAC Name (2r,3r,4r,5s,6s)-2-[[(3s,5r,8r,9s,10s,13r,14s,16s,17r)-16-acetyloxy-14-hydroxy-10,13-dimethyl-17-(5-oxo-2,4-dihydrofuran-4-id-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-methoxy-6-methyl-tetrahydropyran-2,3,4,5,6-pentaide-3,5-diolate
Molecular Mass 592.718 g·mol−1
Heat of Formation -1934.4 ± 16.7 kJ·mol−1
Dipole Moment 6.50 ± 1.08 D
Volume 710.29 Å 3
Surface Area 544.79 Å 2
HOMO Energy -9.84 ± 0.55 eV
LUMO Energy 2.88 ± eV
Point Group Symmetry C1
InChIKey UZQOZJNEDXAJEZ-IPEWOBCYSA-N
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