(2S)-2-azanyl-6-[methyl-[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]amino]hexanoic acid

Systemtic Name: (2S)-2-azanyl-6-[methyl-[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]amino]hexanoic acid Openeye Name: (2S)-2-amino-6-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]-methyl-amino]hexanoic acid CAS Name: (2S)-2-amino-6-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridinyl]-methylamino]hexanoic acid IUPAC Name: (2S)-2-amino-6-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]-methylamino]hexanoic acid Traditional Name: (2S)-2-amino-6-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]-methyl-amino]hexanoic acid Formula: C14H24N3O7P MolecularWeight: 377.330021

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H24N3O7P/c1-9-13(18)12(10(7-16-9)8-24-25(21,22)23)17(2)6-4-3-5-11(15)14(19)20/h7,11,18H,3-6,8,15H2,1-2H3,(H,19,20)(H2,21,22,23)/t11-/m0/s1