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

Systemtic Name: 2-azanyl-4-[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]butanoic acid Openeye Name: 2-amino-4-[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]butanoic acid CAS Name: 2-amino-4-[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridinyl]butanoic acid IUPAC Name: 2-amino-4-[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]butanoic acid Traditional Name: 2-amino-4-[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]butyric acid Formula: C11H17N2O7P MolecularWeight: 320.235641

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C1O)CCC(C(=O)O)N)COP(=O)(O)O

Isomeric SMILES

CC1=NC=C(C(=C1O)CCC(C(=O)O)N)COP(=O)(O)O

InChI

InChI=1S/C11H17N2O7P/c1-6-10(14)8(2-3-9(12)11(15)16)7(4-13-6)5-20-21(17,18)19/h4,9,14H,2-3,5,12H2,1H3,(H,15,16)(H2,17,18,19)