Chem
J-GLOBAL ID:200907038893773735   Nikkaji number:J386.943A

3-[[[2-Methyl-3-hydroxy-5-(phosphonooxymethyl)-4-pyridyl]methyl]amino]benzoic acid

3-[[[2-メチル-3-ヒドロキシ-5-(ホスホノオキシメチル)-4-ピリジル]メチル]アミノ]安息香酸
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: C15H17N2O7P
Molecular formula furigana: C15-H17-N2-O7-P
Molecular weight: 368.282
InChI: InChI=1S/C15H17N2O7P/c1-9-14(18)13(11(6-16-9)8-24-25(21,22)23)7-17-12-4-2-3-10(5-12)15(19)20/h2-6,17-18H,7-8H2,1H3,(H,19,20)(H2,21,22,23)
InChI key: WSOQXCGRIUHULI-UHFFFAOYSA-N
SMILES: Cc1ncc(COP(=O)(O)O)c(CNc2cccc(c2)C(=O)O)c1O
Systematic name  (4):
  • 3-[[(2-メチル-5-[(ホスホノオキシ)メチル]-3-ヒドロキシピリジン-4-イル)メチル]アミノ]安息香酸
  • 3-[[[2-メチル-3-ヒドロキシ-5-(ホスホノオキシメチル)-4-ピリジル]メチル]アミノ]安息香酸
  • 3-[({3-ヒドロキシ-2-メチル-5-[(ホスホノオキシ)メチル]ピリジン-4-イル}メチル)アミノ]安息香酸
  • 3-[({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methyl)amino]benzoic acid
Other name (2):
  • 3-[[(2-Methyl-5-[(phosphonooxy)methyl]-3-hydroxypyridin-4-yl)methyl]amino]benzoic acid
  • 3-[[[2-Methyl-3-hydroxy-5-(phosphonooxymethyl)-4-pyridyl]methyl]amino]benzoic acid
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