8-Methoxy-3-Methyl-7,12-Dioxo-7,12-Dihydro-1-Tetraphenyl β-D-Glucopyranosiduronic Acid

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Properties Simple | Detailed

Formula C26H22O10
IUPAC Name (2s,3s,4s,5r,6s)-3,4,5-trihydroxy-6-(8-methoxy-3-methyl-7,12-dioxo-benzo[a]anthracen-1-yl)oxy-tetrahydropyran-2-carboxylic acid
Molecular Mass 494.447 g·mol−1
Heat of Formation -1451.3 ± 16.7 kJ·mol−1
Dipole Moment 5.69 ± 1.08 D
Volume 531.58 Å 3
Surface Area 395.32 Å 2
HOMO Energy -8.85 ± 0.55 eV
LUMO Energy 2.74 ± eV
Point Group Symmetry C1
InChIKey AMWRMWBDZWNIIN-TYUWDEHNSA-N
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Elements H C O