Chem
J-GLOBAL ID：201707013318775254   Nikkaji number：J3.600.965I

(S)-2-(4-Carboxybenzyl)-5-(hydroxyamino)-5-oxopentanoic acid

(S)-2-(4-カルボキシベンジル)-5-(ヒドロキシアミノ)-5-オキソペンタン酸
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： C13H15NO6
Molecular formula furigana： C13-H15-N-O6
Molecular weight： 281.264
InChI： InChI=1S/C13H15NO6/c15-11(14-20)6-5-10(13(18)19)7-8-1-3-9(4-2-8)12(16)17/h1-4,10,20H,5-7H2,(H,14,15)(H,16,17)(H,18,19)/t10-/m0/s1
InChI key： VUDGMYIWOPKVSL-JTQLQIEISA-N
SMILES： ONC(=O)CC[C@@H](Cc1ccc(cc1)C(=O)O)C(=O)O
Systematic name  (3)：
  • (S)-2-(4-カルボキシベンジル)-5-(ヒドロキシアミノ)-5-オキソペンタン酸
  • 4-[(2S)-2-カルボキシ-2-[2-(ヒドロキシカルバモイル)エチル]エチル]安息香酸
  • 4-[(2S)-2-carboxy-2-[2-(hydroxycarbamoyl)ethyl]ethyl]benzoic acid
Other name (1)：
  • (S)-2-(4-Carboxybenzyl)-5-(hydroxyamino)-5-oxopentanoic acid
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