Chem
J-GLOBAL ID:200907083444860955   Nikkaji number:J386.942C

4-[[(2-Methyl-5-[(phosphonooxy)methyl]-3-hydroxypyridin-4-yl)methyl]amino]butyric acid

4-[[(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]酪酸
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: C12H19N2O7P
Molecular formula furigana: C12-H19-N2-O7-P
Molecular weight: 334.265
InChI: InChI=1S/C12H19N2O7P/c1-8-12(17)10(6-13-4-2-3-11(15)16)9(5-14-8)7-21-22(18,19)20/h5,13,17H,2-4,6-7H2,1H3,(H,15,16)(H2,18,19,20)
InChI key: DOHWOHSLOVXAFH-UHFFFAOYSA-N
SMILES: Cc1ncc(COP(=O)(O)O)c(CNCCCC(=O)O)c1O
Systematic name  (3):
  • 4-[[(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]酪酸
  • 4-[({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]ブタン酸
  • 4-[({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methyl)amino]butanoic acid
Other name (1):
  • 4-[[(2-Methyl-5-[(phosphonooxy)methyl]-3-hydroxypyridin-4-yl)methyl]amino]butyric acid
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