2-azanylethanoic acid; [5-(hydroxymethyl)-2-methyl-3-oxidanyl-pyridin-4-yl] methyl phosphate

Systemtic Name: 2-azanylethanoic acid; [5-(hydroxymethyl)-2-methyl-3-oxidanyl-pyridin-4-yl] methyl phosphate Openeye Name: 2-aminoacetic acid; [3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridyl] methyl phosphate CAS Name: 2-aminoacetic acid; [3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl] methyl phosphate IUPAC Name: 2-aminoacetic acid; [3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl] methyl phosphate Traditional Name: 2-aminoacetic acid; (3-hydroxy-2-methyl-5-methylol-4-pyridyl) methyl phosphate Formula: C10H16N2O8P- MolecularWeight: 323.216401

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C1O)OP(=O)([O-])OC)CO.C(C(=O)O)N

Isomeric SMILES

CC1=NC=C(C(=C1O)OP(=O)([O-])OC)CO.C(C(=O)O)N

InChI

InChI=1S/C8H12NO6P.C2H5NO2/c1-5-7(11)8(6(4-10)3-9-5)15-16(12,13)14-2;3-1-2(4)5/h3,10-11H,4H2,1-2H3,(H,12,13);1,3H2,(H,4,5)/p-1