[(2R,3S,4S,4Ar,10Bs)-3,4,8,10-Tetrahydroxy-9-Methoxy-6-Oxo-2,3,4,4A,6,10B-Hexahydropyrano[3,2-C]Isochromen-2-Yl]Methyl 3,4,5-Trihydroxybenzoate

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Formula C21H20O13
IUPAC Name [(2s,3r,4r,4ar,10br)-3,4,8,10-tetrahydroxy-9-methoxy-6-oxo-3,4,4a,10b-tetrahydro-2h-pyrano[3,2-c]isochromen-2-yl]methyl 3,4,5-trihydroxybenzoate
Molecular Mass 480.376 g·mol−1
Heat of Formation -2108.5 ± 16.7 kJ·mol−1
Dipole Moment 4.72 ± 1.08 D
Volume 493.08 Å 3
Surface Area 349.07 Å 2
HOMO Energy -9.11 ± 0.55 eV
LUMO Energy -1.70 ± eV
Point Group Symmetry C1
InChIKey CDRRULDABVKKHU-NIAMAJQZSA-N
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