2-[[4-(hydroxymethyl)-6-methyl-5-oxidanyl-pyridin-3-yl]methylamino]ethylphosphonic acid

Systemtic Name: 2-[[4-(hydroxymethyl)-6-methyl-5-oxidanyl-pyridin-3-yl]methylamino]ethylphosphonic acid Openeye Name: 2-[[5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridyl]methylamino]ethylphosphonic acid CAS Name: 2-[[5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]methylamino]ethylphosphonic acid IUPAC Name: 2-[[5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]methylamino]ethylphosphonic acid Traditional Name: 2-[(5-hydroxy-6-methyl-4-methylol-3-pyridyl)methylamino]ethylphosphonic acid Formula: C10H17N2O5P MolecularWeight: 276.226141

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C1O)CO)CNCCP(=O)(O)O

Isomeric SMILES

CC1=NC=C(C(=C1O)CO)CNCCP(=O)(O)O

InChI

InChI=1S/C10H17N2O5P/c1-7-10(14)9(6-13)8(5-12-7)4-11-2-3-18(15,16)17/h5,11,13-14H,2-4,6H2,1H3,(H2,15,16,17)