Chem
J-GLOBAL ID：200907025293867154   Nikkaji number：J622.048G

(7E,7′E)-5′,8-Diferulic acid

(7E,7′E)-5′,8-ジフェルラ酸
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： C20H18O8
Molecular formula furigana： C20-H18-O8
Molecular weight： 386.356
InChI： InChI=1S/C20H18O8/c1-27-16-9-11(3-5-15(16)21)8-14(20(25)26)13-7-12(4-6-18(22)23)10-17(28-2)19(13)24/h3-10,21,24H,1-2H3,(H,22,23)(H,25,26)/b6-4+,14-8+
InChI key： DEPVSDIYICBTJE-SITOFEAGSA-N
SMILES： COc1cc(/C=C(/C(=O)O)\c2cc(/C=C/C(=O)O)cc(OC)c2O)ccc1O
Systematic name  (10)：
  • 3,3′-ジメトキシ-4,4′-ジヒドロキシ-α,5′-ビ(trans-けい皮酸)
  • 3-[(E)-α-カルボキシ-4-ヒドロキシ-3-メトキシスチリル]-4-ヒドロキシ-5-メトキシ-trans-けい皮酸
  • (E)-3-(3-メトキシ-4-ヒドロキシフェニル)-2-[5-[(E)-3-ヒドロキシ-3-オキソ-1-プロペニル]-2-ヒドロキシ-3-メトキシフェニル]プロペン酸
  • 3,3′-ジメトキシ-4,4′-ジヒドロキシ-5,α′-ビ(trans-けい皮酸)
  • 4,4′-ジヒドロキシ-3,5′-ジメトキシ-α,3′-ビ(trans-けい皮酸)
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Other name (7)：
  • 3,3′-Dimethoxy-4,4′-dihydroxy-5,α′-bi(trans-cinnamic acid)
  • 4,4′-Dihydroxy-3,5′-dimethoxy-α,3′-bi(trans-cinnamic acid)
  • α,5′-Bi(3-methoxy-4-hydroxy-trans-cinnamic acid)
  • (E)-3-(4-Hydroxy-3-methoxyphenyl)-2-[2-hydroxy-3-methoxy-5-[(E)-2-(carboxy)ethenyl]phenyl]acrylic acid
  • (E)-3-[3-Methoxy-4-hydroxy-5-[(E)-1-carboxy-2-(3-methoxy-4-hydroxyphenyl)vinyl]phenyl]acrylic acid
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