Chem
J-GLOBAL ID：200907013191084050   Nikkaji number：J322.966A

Phillygenin

フィリゲニン
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： C21H24O6
Molecular formula furigana： C21-H24-O6
Molecular weight： 372.417
InChI： InChI=1S/C21H24O6/c1-23-17-7-5-13(9-19(17)25-3)21-15-11-26-20(14(15)10-27-21)12-4-6-16(22)18(8-12)24-2/h4-9,14-15,20-22H,10-11H2,1-3H3/t14-,15-,20+,21-/m0/s1
InChI key： CPJKKWDCUOOTEW-YJPXFSGGSA-N
SMILES： COc1ccc(cc1OC)[C@@H]1OC[C@H]2[C@@H]1CO[C@@H]2c1ccc(O)c(OC)c1
Systematic name  (6)：
  • (1S,3aβ,6aβ)-テトラヒドロ-1β-(4-ヒドロキシ-3-メトキシフェニル)-4α-(3,4-ジメトキシフェニル)-1H,3H-フロ[3,4-c]フラン
  • (1S,3aβ,6aβ)-1β-(3-メトキシ-4-ヒドロキシフェニル)-4α-(3,4-ジメトキシフェニル)テトラヒドロ-1H,3H-フロ[3,4-c]フラン
  • (1S)-1β-(3-メトキシ-4-ヒドロキシフェニル)-4α-(3,4-ジメトキシフェニル)-3aβ,4,6,6aβ-テトラヒドロ-1H,3H-フロ[3,4-c]フラン
  • 4-[[(1S)-4α-(3,4-ジメトキシフェニル)-3aβ,4,6,6aβ-テトラヒドロ-1H,3H-フロ[3,4-c]フラン]-1β-イル]-2-メトキシフェノール
  • 4-[(1S,3aR,4R,6aR)-4-(3,4-ジメトキシフェニル)-ヘキサヒドロフロ[3,4-c]フラン-1-イル]-2-メトキシフェノール
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Other name (9)：
  • フィリゲニン
  • Phillygenin
  • (1S)-1β-(3-Methoxy-4-hydroxyphenyl)-4α-(3,4-dimethoxyphenyl)-3aβ,4,6,6aβ-tetrahydro-1H,3H-furo[3,4-c]furan
  • (1S,3aβ,6aβ)-1β-(3-Methoxy-4-hydroxyphenyl)-4α-(3,4-dimethoxyphenyl)tetrahydro-1H,3H-furo[3,4-c]furan
  • 4-[[(1S)-4α-(3,4-Dimethoxyphenyl)-3aβ,4,6,6aβ-tetrahydro-1H,3H-furo[3,4-c]furan]-1β-yl]-2-methoxyphenol
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CAS registry number： 487-39-8
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