14-Hydroxy-19-Oxo-3-(Pentopyranosyloxy)Carda-4,20(22)-Dienolide

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Formula C28H38O9
IUPAC Name (3s,8r,9s,10s,13r,14s,17r)-14-hydroxy-13-methyl-17-(5-oxo-2h-furan-3-yl)-3-[(2s,3r,4s,5s)-3,4,5-trihydroxytetrahydropyran-2-yl]oxy-1,2,3,6,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthrene-10-carbaldehyde
Molecular Mass 518.596 g·mol−1
Heat of Formation -1618.2 ± 16.7 kJ·mol−1
Dipole Moment 5.89 ± 1.08 D
Volume 594.88 Å 3
Surface Area 459.79 Å 2
HOMO Energy -9.89 ± 0.55 eV
LUMO Energy -0.16 ± eV
Point Group Symmetry C1
InChIKey ZQVQSPBMCILIHV-WSDZJMHASA-N
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