Chem
J-GLOBAL ID：200907050964050080
Nikkaji number：J598.335E
Prephenate
プレフェン酸
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
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
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)/t6-,10+
InChI key：
FPWMCUPFBRFMLH-XGAOUMNUSA-N
SMILES：
O[C@H]1C=C[C@](CC(=O)C(=O)O)(C=C1)C(=O)O
Systematic name (8)：
- 1α-カルボキシ-4α-ヒドロキシ-α-オキソ-2,5-シクロヘキサジエン-1-プロピオン酸
- 1α-カルボキシ-4α-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
- 3-(1β-カルボキシ-4β-ヒドロキシ-2,5-シクロヘキサジエニル)ピルビン酸
- α-オキソ-1-カルボキシ-4α-ヒドロキシ-2,5-シクロヘキサジエン-1β-プロパン酸
- α-オキソ-1-カルボキシ-4α-ヒドロキシ-2,5-シクロヘキサジエン-1β-プロピオン酸
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- 1α-Carboxy-4α-hydroxy-α-oxo-2,5-cyclohexadiene-1-propanoic acid
- 1α-Carboxy-4α-hydroxy-α-oxo-2,5-cyclohexadiene-1-propionic acid
- 3-(1β-Carboxy-4β-hydroxy-2,5-cyclohexadienyl)pyruvic acid
- α-Oxo-1-carboxy-4α-hydroxy-2,5-cyclohexadiene-1β-propanoic acid
- α-Oxo-1-carboxy-4α-hydroxy-2,5-cyclohexadiene-1β-propionic acid
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