Chem
J-GLOBAL ID：200907091290390953   Nikkaji number：J2.756.587E

3-Carboxymethylmuconate

3-カルボキシメチルムコン酸
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： C8H8O6
Molecular formula furigana： C8-H8-O6
Molecular weight： 200.146
InChI： InChI=1S/C8H8O6/c9-6(10)2-1-5(3-7(11)12)4-8(13)14/h1-3H,4H2,(H,9,10)(H,11,12)(H,13,14)/b2-1+,5-3+
InChI key： YISIGATXJQLDCC-NRNIAZNESA-N
SMILES： OC(=O)C/C(=C/C(=O)O)/C=C/C(=O)O
Systematic name  (3)：
  • (2Z,4E)-3-(カルボキシメチル)-2,4-ヘキサジエン二酸
  • (2Z,4E)-3-(カルボキシメチル)ヘキサ-2,4-ジエン二酸
  • (2Z,4E)-3-(carboxymethyl)hexa-2,4-dienedioic acid
Other name (3)：
  • (2Z,4E)-3-(Carboxymethyl)-2,4-hexadienedioic acid
  • 3-Carboxymethylmuconate
  • 3-カルボキシメチルムコン酸
KEGG COMPOUND： C05592
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