1-(1,2,3,8,13,14,15-Heptahydroxy-5,11-Dioxo-5,8,9,11-Tetrahydro-7H-Dibenzo[G,I][1,5]Dioxacycloundecin-7-Yl)-1-Hydroxy-3-Oxo-2-Propanyl 3,4,5-Trihydroxybenzoate

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Formula C27H22O18
IUPAC Name [(1s,2s)-1-formyl-2-[(10s,11r)-3,4,5,11,17,18,19-heptahydroxy-8,14-dioxo-9,13-dioxatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]-2-hydroxy-ethyl] 3,4,5-trihydroxybenzoate
Molecular Mass 634.453 g·mol−1
Heat of Formation -2845.1 ± 16.7 kJ·mol−1
Dipole Moment 4.52 ± 1.08 D
Volume 642.29 Å 3
Surface Area 469.25 Å 2
HOMO Energy -8.95 ± 0.55 eV
LUMO Energy -1.31 ± eV
Point Group Symmetry C1
InChIKey KIWFFZKABNOAQU-JISOWQDMSA-N
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