Chem
J-GLOBAL ID:200907099238336178   Nikkaji number:J11.064G

Austrobailignan 7

アウストロバイリグナン7
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C20H22O5
Molecular formula furigana: C20-H22-O5
Molecular weight: 342.391
InChI: InChI=1S/C20H22O5/c1-11-12(2)20(14-5-7-16-18(9-14)24-10-23-16)25-19(11)13-4-6-15(21)17(8-13)22-3/h4-9,11-12,19-21H,10H2,1-3H3/t11-,12-,19+,20-/m0/s1
InChI key: JPDORDSJPIKURD-UAFHBQARSA-N
SMILES: COc1cc(ccc1O)[C@@H]1O[C@@H]([C@@H](C)[C@@H]1C)c1ccc2OCOc2c1
Systematic name  (3):
  • 4-[(2R)-5β-(1,3-ベンゾジオキソール-5-イル)テトラヒドロ-3β,4α-ジメチルフラン-2-イル]-2-メトキシフェノール
  • 4-[(2R,3S,4S,5S)-5-(2H-1,3-ベンゾジオキソール-5-イル)-3,4-ジメチルオキソラン-2-イル]-2-メトキシフェノール
  • 4-[(2R,3S,4S,5S)-5-(2H-1,3-benzodioxol-5-yl)-3,4-dimethyloxolan-2-yl]-2-methoxyphenol
Other name (3):
  • アウストロバイリグナン7
  • Austrobailignan 7
  • 4-[(2R)-5β-(1,3-Benzodioxol-5-yl)tetrahydro-3β,4α-dimethylfuran-2-yl]-2-methoxyphenol
CAS registry number: 55890-25-0
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