(2S,3S)-2-(3,4-Dihydroxyphenyl)-3,5,7-Trihydroxy-6,8-Bis(4-Hydroxybenzyl)-2,3-Dihydro-4H-Chromen-4-One

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Properties Simple | Detailed

Formula C29H24O9
IUPAC Name 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6,8-bis[(4-hydroxyphenyl)methyl]chroman-4-one
Molecular Mass 516.495 g·mol−1
Heat of Formation -1302.3 ± 16.7 kJ·mol−1
Dipole Moment 2.51 ± 1.08 D
Volume 578.8 Å 3
Surface Area 454.96 Å 2
HOMO Energy -8.88 ± 0.55 eV
LUMO Energy 2.10 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3s)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6,8-bis(4-hydroxybenzyl)chroman-4-one
  • (2s,3s)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6,8-bis[(4-hydroxyphenyl)methyl]-4-chromanone
InChIKey NSDIRDXLZWLHAL-IZLXSDGUSA-N
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