(Z,2S)-2-azanyl-7-[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]-5-oxidanyl-hept-5-enoic acid

Systemtic Name: (Z,2S)-2-azanyl-7-[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]-5-oxidanyl-hept-5-enoic acid Openeye Name: (Z,2S)-2-amino-5-hydroxy-7-[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]hept-5-enoic acid CAS Name: (Z,2S)-2-amino-5-hydroxy-7-[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridinyl]-5-heptenoic acid IUPAC Name: (Z,2S)-2-amino-5-hydroxy-7-[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]hept-5-enoic acid Traditional Name: (Z,2S)-2-amino-5-hydroxy-7-[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]hept-5-enoic acid Formula: C14H21N2O8P MolecularWeight: 376.298901

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=NC=C(C(=C1O)C/C=C(/CC[C@@H](C(=O)O)N)\O)COP(=O)(O)O

InChI

InChI=1S/C14H21N2O8P/c1-8-13(18)11(9(6-16-8)7-24-25(21,22)23)4-2-10(17)3-5-12(15)14(19)20/h2,6,12,17-18H,3-5,7,15H2,1H3,(H,19,20)(H2,21,22,23)/b10-2-/t12-/m0/s1