(+)-Syringaresinol

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Properties Simple | Detailed

Formula C22H26O8
IUPAC Name 4-[(3s,3ar,6s,6ar)-6-(4-hydroxy-3,5-dimethoxy-phenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2,6-dimethoxy-phenol
Molecular Mass 418.437 g·mol−1
Heat of Formation -1137.4 ± 16.7 kJ·mol−1
Dipole Moment 4.84 ± 1.08 D
Volume 473.08 Å 3
Surface Area 417.98 Å 2
HOMO Energy -8.56 ± 0.55 eV
LUMO Energy 0.19 ± eV
Point Group Symmetry C1
Synonyms
  • (7alpha,7'alpha,8alpha,8'alpha)-3,3',5,5'-tetramethoxy-7,9':7',9-diepoxylignane-4,4'-diol
  • 4-[(1s,3ar,4s,6ar)-4-(4-hydroxy-3,5-dimethoxy-phenyl)-1,3,3a,4,6,6a-hexahydrofuro[4,3-c]furan-1-yl]-2,6-dimethoxy-phenol
  • 4-[(1s,3ar,4s,6ar)-4-(4-hydroxy-3,5-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[4,3-c]furan-1-yl]-2,6-dimethoxyphenol
CAS Number(s)
  • 21453-69-0
InChIKey KOWMJRJXZMEZLD-HCIHMXRSSA-N
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