6-[[6-(acetamidomethyl)-4-methyl-5-oxidanyl-pyridin-3-yl]methoxy-oxidanyl-phosphoryl]hexanoic acid

Systemtic Name: 6-[[6-(acetamidomethyl)-4-methyl-5-oxidanyl-pyridin-3-yl]methoxy-oxidanyl-phosphoryl]hexanoic acid Openeye Name: 6-[[6-(acetamidomethyl)-5-hydroxy-4-methyl-3-pyridyl]methoxy-hydroxy-phosphoryl]hexanoic acid CAS Name: 6-[[6-(acetamidomethyl)-5-hydroxy-4-methyl-3-pyridinyl]methoxy-hydroxyphosphoryl]hexanoic acid IUPAC Name: 6-[[6-(acetamidomethyl)-5-hydroxy-4-methylpyridin-3-yl]methoxy-hydroxyphosphoryl]hexanoic acid Traditional Name: 6-[[6-(acetamidomethyl)-5-hydroxy-4-methyl-3-pyridyl]methoxy-hydroxy-phosphoryl]hexanoic acid Formula: C16H25N2O7P MolecularWeight: 388.352661

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC=C1COP(=O)(CCCCCC(=O)O)O)CNC(=O)C)O

Isomeric SMILES

CC1=C(C(=NC=C1COP(=O)(CCCCCC(=O)O)O)CNC(=O)C)O

InChI

InChI=1S/C16H25N2O7P/c1-11-13(8-18-14(16(11)22)9-17-12(2)19)10-25-26(23,24)7-5-3-4-6-15(20)21/h8,22H,3-7,9-10H2,1-2H3,(H,17,19)(H,20,21)(H,23,24)