Chem
J-GLOBAL ID:200907071839935930   Nikkaji number:J38.009A

Prephenic acid

プレフェニン酸
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: C10H10O6
Molecular formula furigana: C10-H10-O6
Molecular weight: 226.184
InChI: InChI=1S/C10H10O6/c11-6-1-3-10(4-2-6,9(15)16)5-7(12)8(13)14/h1-4,6,11H,5H2,(H,13,14)(H,15,16)
InChI key: FPWMCUPFBRFMLH-UHFFFAOYSA-N
SMILES: OC1C=CC(CC(=O)C(=O)O)(C=C1)C(=O)O
Systematic name  (4):
  • 1-カルボキシ-4-ヒドロキシ-α-オキソ-2,5-シクロヘキサジエン-1-プロパン酸
  • α-オキソ-1-カルボキシ-4-ヒドロキシ-2,5-シクロヘキサジエン-1β-プロパン酸
  • 1-(2-カルボキシ-2-オキソエチル)-4-ヒドロキシシクロヘキサ-2,5-ジエン-1-カルボン酸
  • 1-(2-carboxy-2-oxoethyl)-4-hydroxycyclohexa-2,5-diene-1-carboxylic acid
Other name (7):
  • プレフェニン酸
  • Prephenic acid
  • 1-Carboxy-4-hydroxy-α-oxo-2,5-cyclohexadiene-1-propanoic acid
  • α-Oxo-1-carboxy-4-hydroxy-2,5-cyclohexadiene-1β-propanoic acid
  • プレフェナート
Show all
CAS registry number: 126-49-8
KEGG COMPOUND: C00254
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