5,7-Dihydroxy-2-[4-Hydroxy-3-(3-Methyl-2-Buten-1-Yl)Phenyl]-6-(3-Methyl-2-Buten-1-Yl)-4H-Chromen-4-One

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Formula C25H26O5
IUPAC Name 5,7-dihydroxy-2-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]-6-(3-methylbut-2-enyl)chromen-4-one
Molecular Mass 406.471 g·mol−1
Heat of Formation -734.0 ± 16.7 kJ·mol−1
Dipole Moment 3.33 ± 1.08 D
Volume 495.11 Å 3
Surface Area 415.28 Å 2
HOMO Energy -9.10 ± 0.55 eV
LUMO Energy -0.91 ± eV
Point Group Symmetry C1
Synonyms
  • 5,7-dihydroxy-2-(4-hydroxy-3-((e)-3-methyl-but-2-enyl)-phenyl)-6-(3-methyl-but-2-enyl)-1-benzopyran-4-one
  • 5,7-dihydroxy-2-[4-hydroxy-3-((e)-3-methyl-but-2-enyl)-phenyl]-6-(3-methyl-but-2-enyl)-1-benzopyran-4-one
  • 5,7-dihydroxy-2-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]-6-(3-methylbut-2-enyl)-4-chromenone
  • 5,7-dihydroxy-2-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]-6-(3-methylbut-2-enyl)chromone
  • gancaonin q
CAS Number(s)
  • 134958-52-4
InChIKey WGNIVAMNAWBYRO-UHFFFAOYSA-N
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