(1S,11R,12S,13R,14R,15S,25R,26S,27R,28R)-12,13,14,26,27,28-Hexahydroxy-3,7,17,21-Tetramethyl-3,17-Divinyl-2,9,16,23,29,30-Hexaoxatricyclo[23.3.1.1~11,15~]Triaconta-6,20-Diene-8,22-Dione (Non-Preferred Name)

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Formula C32H48O14
IUPAC Name (1s,3s,6e,11r,12r,13s,14s,15s,17s,20e,25r,26r,27r,28r)-12,13,14,26,27,28-hexahydroxy-3,7,17,21-tetramethyl-3,17-divinyl-2,9,16,23,29,30-hexaoxatricyclo[23.3.1.111,15]triaconta-6,20-diene-8,22-dione
Molecular Mass 656.715 g·mol−1
Heat of Formation -2470.4 ± 16.7 kJ·mol−1
Dipole Moment 8.02 ± 1.08 D
Volume 770.19 Å 3
Surface Area 523.92 Å 2
HOMO Energy -9.51 ± 0.55 eV
LUMO Energy 0.25 ± eV
Point Group Symmetry C1
Synonyms
  • (6e,20e)-12,13,14,26,27,28-hexahydroxy-3,7,17,21-tetramethyl-3,17-divinyl-2,9,16,23,29,30-hexaoxatricyclo[23.3.1.1~11,15~]triaconta-6,20-diene-8,22-dione (non-preferred name)
  • 12,13,14,26,27,28-hexahydroxy-3,7,17,21-tetramethyl-3,17-divinyl-2,9,16,23,29,30-hexaoxa-tricyclo[23.3.1.1^(11,15)]triaconta-6,20-diene-8,22-dione
  • benzeneethanol, 4-hydroxy-beta-methoxy-, (betar)-
InChIKey IINZASCKGHCXIA-BZBIQRFCSA-N
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