Chem
J-GLOBAL ID：200907025795873255   Nikkaji number：J1.242.766B

5′-Phosphonopyridoxyl-2-methylalanine

5′-ホスホノピリドキシル-2-メチルアラニン
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/c1-7-10(15)9(5-14-12(2,3)11(16)17)8(4-13-7)6-21-22(18,19)20/h4,14-15H,5-6H2,1-3H3,(H,16,17)(H2,18,19,20)
InChI key： NHGDGJKONAZETF-UHFFFAOYSA-N
SMILES： Cc1ncc(COP(=O)(O)O)c(CNC(C)(C)C(=O)O)c1O
Systematic name  (3)：
  • N-[2-メチル-3-ヒドロキシ-5-[(ホスホノオキシ)メチル]ピリジン-4-イルメチル]-2-メチル-L-アラニン
  • 2-[({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]-2-メチルプロパン酸
  • 2-[({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methyl)amino]-2-methylpropanoic acid
Other name (3)：
  • N-[2-Methyl-3-hydroxy-5-[(phosphonooxy)methyl]pyridine-4-ylmethyl]-2-methyl-L-alanine
  • 5′-Phosphonopyridoxyl-2-methylalanine
  • 5′-ホスホノピリドキシル-2-メチルアラニン
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