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

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Properties Simple | Detailed

Formula C20H24O7
IUPAC Name 4-[(2r,3s,4s)-4-[(s)-hydroxy-(3-hydroxy-5-methoxy-phenyl)methyl]-3-(hydroxymethyl)tetrahydrofuran-2-yl]-2-methoxy-phenol
Molecular Mass 376.400 g·mol−1
Heat of Formation -1090.5 ± 16.7 kJ·mol−1
Dipole Moment 4.03 ± 1.08 D
Volume 445.75 Å 3
Surface Area 368.95 Å 2
HOMO Energy -8.74 ± 0.55 eV
LUMO Energy -0.35 ± eV
Point Group Symmetry C1
Synonyms
  • 4-[(2r,3s,4s)-4-[(s)-hydroxy-(3-hydroxy-5-methoxy-phenyl)methyl]-3-(hydroxymethyl)oxolan-2-yl]-2-methoxy-phenol
  • 4-[(2r,3s,4s)-4-[(s)-hydroxy-(3-hydroxy-5-methoxy-phenyl)methyl]-3-(hydroxymethyl)tetrahydrofuran-2-yl]-2-methoxy-phenol
  • 4-[(2r,3s,4s)-4-[(s)-hydroxy-(3-hydroxy-5-methoxy-phenyl)methyl]-3-methylol-tetrahydrofuran-2-yl]-2-methoxy-phenol
  • 4-[(2r,3s,4s)-4-[(s)-hydroxy-(3-hydroxy-5-methoxyphenyl)methyl]-3-(hydroxymethyl)-2-tetrahydrofuranyl]-2-methoxyphenol
  • 4-[(2r,3s,4s)-4-[(s)-hydroxy-(3-hydroxy-5-methoxyphenyl)methyl]-3-(hydroxymethyl)oxolan-2-yl]-2-methoxyphenol
InChIKey PMLAAAIZDRPWMW-SMOSDQRPSA-N
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