(4As,7S,7As)-7-Methyl-1-{[(2S,3R,4R,6R)-3,4,5,5,6-Pentahydroxy-6-(Hydroxymethyl)Tetrahydro-2H-Pyran-2-Yl]Oxy}-1,4A,5,6,7,7A-Hexahydrocyclopenta[C]Pyran-7-Yl Acetate

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Formula C17H26O11
IUPAC Name [(1s,4as,7s,7as)-7-methyl-1-[(2s,3r,4r,6r)-3,4,5,5,6-pentahydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-4a,5,6,7a-tetrahydro-1h-cyclopenta[c]pyran-7-yl] acetate
Molecular Mass 406.382 g·mol−1
Heat of Formation -2086.3 ± 16.7 kJ·mol−1
Dipole Moment 1.15 ± 1.08 D
Volume 441.77 Å 3
Surface Area 337.01 Å 2
HOMO Energy -9.57 ± 0.55 eV
LUMO Energy 0.37 ± eV
Point Group Symmetry C1
InChIKey NJJKLOCFAWWZNT-YNTRKKHNSA-N
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