3-{3-[(E)-2-{(1S,2S)-2-[5-(5,7-Dihydroxy-4-Oxo-4H-Chromen-3-Yl)-2-Hydroxyphenyl]-1,4-Dimethyl-3-Cyclohexen-1-Yl}Vinyl]-4-Hydroxyphenyl}-5,7-Dihydroxy-4H-Chromen-4-One

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Properties Simple | Detailed

Formula C40H32O10
IUPAC Name 3-[3-[(e)-2-[(1s,2s)-2-[5-(5,7-dihydroxy-4-oxo-chromen-3-yl)-2-hydroxy-phenyl]-1,4-dimethyl-cyclohex-3-en-1-yl]vinyl]-4-hydroxy-phenyl]-5,7-dihydroxy-chromen-4-one
Molecular Mass 672.676 g·mol−1
Heat of Formation -1340.8 ± 16.7 kJ·mol−1
Dipole Moment 2.17 ± 1.08 D
Volume 761.27 Å 3
Surface Area 512.66 Å 2
HOMO Energy -8.42 ± 0.55 eV
LUMO Energy -0.73 ± eV
Point Group Symmetry C1
InChIKey UXLMHNXEKOQLBQ-DCAFODOZSA-N
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