(2S,3R)-2'-(3,4-Dihydroxyphenyl)-5,5',7,7'-Tetrahydroxy-2-(4-Hydroxyphenyl)-2,3-Dihydro-4H,4'H-3,8'-Bichromene-4,4'-Dione

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Properties Simple | Detailed

Formula C30H20O11
IUPAC Name 8-[(2s,3r)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-chroman-3-yl]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-chromen-4-one
Molecular Mass 556.473 g·mol−1
Heat of Formation -1514.8 ± 16.7 kJ·mol−1
Dipole Moment 6.06 ± 1.08 D
Volume 591.16 Å 3
Surface Area 452.7 Å 2
HOMO Energy -9.23 ± 0.55 eV
LUMO Energy 2.05 ± eV
Point Group Symmetry C1
Synonyms
  • (3,8'-bi-4h-1-benzopyran)-4,4'-dione, 2'-(3,4-dihydroxyphenyl)-2,3-dihydro-5,5',7,7'-tetrahydroxy-2-(4-hydroxyphenyl)-, (2s-trans)-
  • 8-[(2s,3r)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-keto-chroman-3-yl]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-chromone
  • 8-[(2s,3r)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-3-chromanyl]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-chromenone
  • 8-[(2s,3r)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-chroman-3-yl]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-chromen-4-one
  • 8-[(2s,3r)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochroman-3-yl]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one
  • [3,8'-bi-4h-1-benzopyran]-4,4'-dione, 2'-(3,4-dihydroxyphenyl)-2,3-dihydro-5,5',7,7'-tetrahydroxy-2-(4-hydroxyphenyl)-, (2s,3r)-
  • morelloflavone
CAS Number(s)
  • 16851-21-1
InChIKey GFWPWSNIXRDQJC-LMSSTIIKSA-N
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