(1S)-1,5-Anhydro-1-[(9R)-5-(β-D-Glucopyranosyloxy)-4-Hydroxy-2-(Hydroxymethyl)-10-Oxo-9,10-Dihydro-9-Anthracenyl]-D-Glucitol

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Properties Simple | Detailed

Formula C27H32O14
IUPAC Name 1-hydroxy-3-(hydroxymethyl)-10-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]-8-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-10h-anthracen-9-one
Molecular Mass 580.535 g·mol−1
Heat of Formation -89.9 ± 16.7 kJ·mol−1
Dipole Moment 11.93 ± 1.08 D
Volume 510.6 Å 3
Surface Area 443.79 Å 2
HOMO Energy -8.96 ± 0.55 eV
LUMO Energy -3.26 ± eV
Point Group Symmetry C1
InChIKey MNAYRSRTNMVAPR-OPEXUXIQSA-N
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Elements C O