Methyl (4As,7R,7As)-1-(β-D-Allopyranosyloxy)-7-Hydroxy-7-(Hydroxymethyl)-1,4A,7,7A-Tetrahydrocyclopenta[C]Pyran-4-Carboxylate

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Formula C17H24O11
IUPAC Name methyl (1s,4ar,7s,7ar)-7-hydroxy-7-(hydroxymethyl)-1-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-4a,7a-dihydro-1h-cyclopenta[c]pyran-4-carboxylate
Molecular Mass 404.366 g·mol−1
Heat of Formation -1887.7 ± 16.7 kJ·mol−1
Dipole Moment 2.82 ± 1.08 D
Volume 440.0 Å 3
Surface Area 366.26 Å 2
HOMO Energy -10.19 ± 0.55 eV
LUMO Energy -0.53 ± eV
Point Group Symmetry C1
InChIKey XJMPAUZQVRGFRE-GDHAGNFOSA-N
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Elements H C O