(2S)-2-acetamido-5-[[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]pentanoic acid

Systemtic Name: (2S)-2-acetamido-5-[[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]pentanoic acid Openeye Name: (2S)-2-acetamido-5-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]methylamino]pentanoic acid CAS Name: (2S)-2-acetamido-5-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridinyl]methylamino]pentanoic acid IUPAC Name: (2S)-2-acetamido-5-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]pentanoic acid Traditional Name: (2S)-2-acetamido-5-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]methylamino]valeric acid Formula: C15H24N3O8P MolecularWeight: 405.340121

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C1O)CNCCCC(C(=O)O)NC(=O)C)COP(=O)(O)O

Isomeric SMILES

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

InChI

InChI=1S/C15H24N3O8P/c1-9-14(20)12(11(6-17-9)8-26-27(23,24)25)7-16-5-3-4-13(15(21)22)18-10(2)19/h6,13,16,20H,3-5,7-8H2,1-2H3,(H,18,19)(H,21,22)(H2,23,24,25)/t13-/m0/s1