Chem
J-GLOBAL ID：200907062893533244   Nikkaji number：J936.739J

Fukinolic acid

フキノール酸
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： C20H18O11
Molecular formula furigana： C20-H18-O11
Molecular weight： 434.353
InChI： InChI=1S/C20H18O11/c21-12-4-1-10(7-14(12)23)3-6-16(25)31-17(18(26)27)20(30,19(28)29)9-11-2-5-13(22)15(24)8-11/h1-8,17,21-24,30H,9H2,(H,26,27)(H,28,29)/b6-3+/t17-,20-/m1/s1
InChI key： ACYXDIZTQDLTCB-UVIKLTKHSA-N
SMILES： OC(=O)[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)[C@](O)(Cc1ccc(O)c(O)c1)C(=O)O
Systematic name  (4)：
  • (2R,3S)-2-(3,4-ジヒドロキシベンジル)-2-ヒドロキシ-3-(3,4-ジヒドロキシ-trans-シンナモイルオキシ)ブタン二酸
  • (2R,3S)-2-[(3,4-ジヒドロキシフェニル)メチル]-3-[[(E)-3-(3,4-ジヒドロキシフェニル)-1-オキソ-2-プロペニル]オキシ]-2-ヒドロキシブタン二酸
  • (2R,3S)-2-[(3,4-ジヒドロキシフェニル)メチル]-3-{[(2E)-3-(3,4-ジヒドロキシフェニル)プロパ-2-エノイル]オキシ}-2-ヒドロキシブタン二酸
  • (2R,3S)-2-[(3,4-dihydroxyphenyl)methyl]-3-{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-2-hydroxybutanedioic acid
Other name (4)：
  • (2R,3S)-2-(3,4-Dihydroxybenzyl)-2-hydroxy-3-(3,4-dihydroxy-trans-cinnamoyloxy)butanedioic acid
  • (2R,3S)-2-[(3,4-Dihydroxyphenyl)methyl]-3-[[(E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-2-hydroxybutanedioic acid
  • フキノール酸
  • Fukinolic acid
CAS registry number： 50982-40-6
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