(2R)-3-azanyl-2-[[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]propanoic acid

Systemtic Name: (2R)-3-azanyl-2-[[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]propanoic acid Openeye Name: (2R)-3-amino-2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]methylamino]propanoic acid CAS Name: (2R)-3-amino-2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridinyl]methylamino]propanoic acid IUPAC Name: (2R)-3-amino-2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]propanoic acid Traditional Name: (2R)-3-amino-2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]methylamino]propionic acid Formula: C11H18N3O7P MolecularWeight: 335.250281

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C1O)CNC(CN)C(=O)O)COP(=O)(O)O

Isomeric SMILES

CC1=NC=C(C(=C1O)CN[C@H](CN)C(=O)O)COP(=O)(O)O

InChI

InChI=1S/C11H18N3O7P/c1-6-10(15)8(4-14-9(2-12)11(16)17)7(3-13-6)5-21-22(18,19)20/h3,9,14-15H,2,4-5,12H2,1H3,(H,16,17)(H2,18,19,20)/t9-/m1/s1