(2S,3R)-3,5,7-Trihydroxy-2-(2-Hydroxyphenyl)-6-Methoxy-8-(3-Methyl-2-Buten-1-Yl)-2,3-Dihydro-4H-Chromen-4-One

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Properties Simple | Detailed

Formula C21H22O7
IUPAC Name (2s,3r)-3,5,7-trihydroxy-2-(2-hydroxyphenyl)-6-methoxy-8-(3-methylbut-2-enyl)chroman-4-one
Molecular Mass 386.395 g·mol−1
Heat of Formation -1062.6 ± 16.7 kJ·mol−1
Dipole Moment 4.53 ± 1.08 D
Volume 443.48 Å 3
Surface Area 354.35 Å 2
HOMO Energy -8.89 ± 0.55 eV
LUMO Energy -0.71 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3r)-3,5,7-trihydroxy-2-(2-hydroxyphenyl)-6-methoxy-8-(3-methylbut-2-enyl)-4-chromanone
  • (2s,3r)-3,5,7-trihydroxy-2-(2-hydroxyphenyl)-6-methoxy-8-(3-methylbut-2-enyl)chroman-4-one
  • 3,5,7,2'-tetrahydroxy-6-methoxy-8-prenylflavanone
  • 3,5,7-trihydroxy-2-(2-hydroxy-phenyl)-6-methoxy-8-(3-methyl-but-2-enyl)-chroman-4-one
  • 4h-1-benzopyran-4-one, 2,3-dihydro-3,5,7-trihydroxy-2-(2-hydroxyphenyl)-6-methoxy-8-(3-methyl-2-butenyl)-, (2r,3r)-
  • floranol
  • rel-(2r,3s)-3,5,7-trihydroxy-2-(2-hydroxyphenyl)-6-methoxy-8-(3-methylbut-2-en-1-yl)-2,3-dihydro-4h-chromen-4-one
InChIKey XZNFAYXFFDZGJD-ICSRJNTNSA-N
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