Chem
J-GLOBAL ID：200907077132530133   Nikkaji number：J2.751.701C

4-(L-Alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde

4-(L-アラニン-3-イル)-2-ヒドロキシ-cis,cis-ムコン酸6-セミアルデヒド
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： C9H11NO6
Molecular formula furigana： C9-H11-N-O6
Molecular weight： 229.188
InChI： InChI=1S/C9H11NO6/c10-6(8(13)14)3-5(1-2-11)4-7(12)9(15)16/h1-2,4,6,12H,3,10H2,(H,13,14)(H,15,16)/b5-1-,7-4+/t6-/m0/s1
InChI key： FNEGJFDTWWXQES-QTWONPPNSA-N
SMILES： N[C@@H](C/C(=C/C=O)/C=C(/O)\C(=O)O)C(=O)O
Systematic name  (3)：
  • (2E,6S)-6-アミノ-2-ヒドロキシ-4-[(Z)-2-オキソエチリデン]-2-ヘプテン二酸
  • (2E,4Z,6S)-6-アミノ-2-ヒドロキシ-4-(2-オキソエチリデン)ヘプタ-2-エン二酸
  • (2E,4Z,6S)-6-amino-2-hydroxy-4-(2-oxoethylidene)hept-2-enedioic acid
Other name (3)：
  • (2E,6S)-6-Amino-2-hydroxy-4-[(Z)-2-oxoethylidene]-2-heptenedioic acid
  • 4-(L-Alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde
  • 4-(L-アラニン-3-イル)-2-ヒドロキシ-cis,cis-ムコン酸6-セミアルデヒド
KEGG COMPOUND： C04796 ,  C17758
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