(2S,3S)-3-(4-Hydroxy-3-Methoxyphenyl)-2-(Hydroxymethyl)-5-Isopropyl-9,9-Dimethyl-2,3-Dihydro-7H-Benzo[4',5']Cyclohepta[1',2':5,6]Benzo[1,2-B][1,4]Dioxine-7,10(9H)-Dione

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Formula C30H28O7
IUPAC Name (2s,3s)-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-5-isopropyl-9,9-dimethyl-2,3-dihydro-7h-benzo[4',5']cyclohepta[1',2':5,6]benzo[1,2-b][1,4]dioxine-7,10(9h)-dione
Molecular Mass 500.539 g·mol−1
Heat of Formation -874.4 ± 16.7 kJ·mol−1
Dipole Moment 5.13 ± 1.08 D
Volume 592.47 Å 3
Surface Area 489.11 Å 2
HOMO Energy -9.05 ± 0.55 eV
LUMO Energy 1.81 ± eV
Point Group Symmetry C1
InChIKey STCQKVIMCUPRKK-BDYUSTAISA-N
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