Chem
J-GLOBAL ID：200907018969659189   Nikkaji number：J2.437.214F

2-Amino-4-[methyl[4-(carboxymethyl)phenyl]phosphono]butanoic acid

2-アミノ-4-[メチル[4-(カルボキシメチル)フェニル]ホスホノ]ブタン酸
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： C13H18NO7P
Molecular formula furigana： C13-H18-N-O7-P
Molecular weight： 331.261
InChI： InChI=1S/C13H18NO7P/c1-20-22(19,7-6-11(14)13(17)18)21-10-4-2-9(3-5-10)8-12(15)16/h2-5,11H,6-8,14H2,1H3,(H,15,16)(H,17,18)
InChI key： VMSMGPBEDMQSBC-UHFFFAOYSA-N
SMILES： COP(=O)(CCC(N)C(=O)O)Oc1ccc(CC(=O)O)cc1
Systematic name  (3)：
  • 2-アミノ-4-[メチル[4-(カルボキシメチル)フェニル]ホスホノ]ブタン酸
  • 2-アミノ-4-{[4-(カルボキシメチル)フェノキシ](メトキシ)ホスホリル}ブタン酸
  • 2-amino-4-{[4-(carboxymethyl)phenoxy](methoxy)phosphoryl}butanoic acid
Other name (1)：
  • 2-Amino-4-[methyl[4-(carboxymethyl)phenyl]phosphono]butanoic acid
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