4-{(S)-Hydroxy[(3S,4R,5S)-5-(4-Hydroxy-3-Methoxyphenyl)-4-(Hydroxymethyl)Tetrahydro-3-Furanyl]Methyl}-2-Methoxyphenol

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Properties Simple | Detailed

Formula C20H24O7
IUPAC Name 4-[(2s,3r,4s)-4-[(s)-hydroxy-(4-hydroxy-3-methoxy-phenyl)methyl]-3-(hydroxymethyl)tetrahydrofuran-2-yl]-2-methoxy-phenol
Molecular Mass 376.400 g·mol−1
Heat of Formation -1034.1 ± 16.7 kJ·mol−1
Dipole Moment 4.25 ± 1.08 D
Volume 439.87 Å 3
Surface Area 381.44 Å 2
HOMO Energy -8.37 ± 0.55 eV
LUMO Energy -0.12 ± eV
Point Group Symmetry C1
Synonyms
  • 4-[(2s,3r,4s)-4-[(s)-hydroxy-(4-hydroxy-3-methoxy-phenyl)methyl]-3-(hydroxymethyl)oxolan-2-yl]-2-methoxy-phenol
  • 4-[(2s,3r,4s)-4-[(s)-hydroxy-(4-hydroxy-3-methoxy-phenyl)methyl]-3-(hydroxymethyl)tetrahydrofuran-2-yl]-2-methoxy-phenol
  • 4-[(2s,3r,4s)-4-[(s)-hydroxy-(4-hydroxy-3-methoxy-phenyl)methyl]-3-methylol-tetrahydrofuran-2-yl]-2-methoxy-phenol
  • 4-[(2s,3r,4s)-4-[(s)-hydroxy-(4-hydroxy-3-methoxyphenyl)methyl]-3-(hydroxymethyl)-2-tetrahydrofuranyl]-2-methoxyphenol
  • 4-[(2s,3r,4s)-4-[(s)-hydroxy-(4-hydroxy-3-methoxyphenyl)methyl]-3-(hydroxymethyl)oxolan-2-yl]-2-methoxyphenol
InChIKey MWQRAOGWLXTMIC-TUGJPZLJSA-N
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