Spiraeoside

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Properties Simple | Detailed

Formula C21H20O12
IUPAC Name 3,5,7-trihydroxy-2-[3-hydroxy-4-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-phenyl]chromen-4-one
Molecular Mass 464.376 g·mol−1
Heat of Formation -1852.3 ± 16.7 kJ·mol−1
Dipole Moment 4.13 ± 1.08 D
Volume 493.47 Å 3
Surface Area 417.89 Å 2
HOMO Energy -9.23 ± 0.55 eV
LUMO Energy -1.04 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(4-(beta-d-glucopyranosyloxy)-3-hydroxyphenyl)-3,5,7-trihydroxy-4h-1-benzopyran-4-one
  • 3,5,7-trihydroxy-2-[3-hydroxy-4-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-phenyl]chromen-4-one
  • 3,5,7-trihydroxy-2-[3-hydroxy-4-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-4-one
  • 3,5,7-trihydroxy-2-[3-hydroxy-4-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-phenyl]chromen-4-one
  • 3,5,7-trihydroxy-2-[3-hydroxy-4-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-phenyl]chromone
  • 3,5,7-trihydroxy-2-[3-hydroxy-4-[[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]phenyl]-4-chromenone
  • 4h-1-benzopyran-4-one, 2-(4-(beta-d-glucopyranosyloxy)-3-hydroxyphenyl)-3,5,7-trihydroxy-
  • quercetin 4'-o-glucoside
  • quercetin-4'-glucoside
  • spiraein
  • spiraein (acacia)
  • spiraeosid
CAS Number(s)
  • 20229-56-5
InChIKey OIUBYZLTFSLSBY-HMGRVEAOSA-N
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