Chem
J-GLOBAL ID：200907099068813677
Nikkaji number：J8.341K
D-Isocitric acid
D-イソくえん酸
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： C6H8O7
Molecular formula furigana： C6-H8-O7
Molecular weight： 192.123
InChI：
InChI=1S/C6H8O7/c7-3(8)1-2(5(10)11)4(9)6(12)13/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13)/t2-,4+/m0/s1
InChI key：
ODBLHEXUDAPZAU-ZAFYKAAXSA-N
SMILES：
O[C@H]([C@H](CC(=O)O)C(=O)O)C(=O)O
Systematic name (5)：
- 3-カルボキシ-2,3-ジデオキシ-L-threo-ペンタル酸
- (1R,2S)-1-ヒドロキシプロパン-1,2,3-トリカルボン酸
- (2R,3S)-2-ヒドロキシ-3-カルボキシペンタン二酸
- (1R,2S)-1-ヒドロキシ-1,2,3-プロパントリカルボン酸
- (1R,2S)-1-hydroxypropane-1,2,3-tricarboxylic acid
- 2-ヒドロキシトリカルバリル酸
- DS-threo-イソクエン酸
- DS-threo-Isocitric acid
- 2-Hydroxytricarballyllic acid
- 3-Carboxy-2,3-dideoxy-L-threo-pentaric acid
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KEGG COMPOUND：
C00451
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