(2S)-3-[3,4-bis(oxidanyl)phenyl]-2-methyl-2-[2-[[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]methyl]hydrazinyl]propanoic acid

Systemtic Name: (2S)-3-[3,4-bis(oxidanyl)phenyl]-2-methyl-2-[2-[[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]methyl]hydrazinyl]propanoic acid Openeye Name: (2S)-3-(3,4-dihydroxyphenyl)-2-[2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]methyl]hydrazino]-2-methyl-propanoic acid CAS Name: (2S)-3-(3,4-dihydroxyphenyl)-2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridinyl]methylhydrazo]-2-methylpropanoic acid IUPAC Name: (2S)-3-(3,4-dihydroxyphenyl)-2-[2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]methyl]hydrazinyl]-2-methylpropanoic acid Traditional Name: (2S)-3-(3,4-dihydroxyphenyl)-2-[N'-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]methyl]hydrazino]-2-methyl-propionic acid Formula: C18H24N3O9P MolecularWeight: 457.371621

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C1O)CNNC(C)(CC2=CC(=C(C=C2)O)O)C(=O)O)COP(=O)(O)O

Isomeric SMILES

CC1=NC=C(C(=C1O)CNN[C@@](C)(CC2=CC(=C(C=C2)O)O)C(=O)O)COP(=O)(O)O

InChI

InChI=1S/C18H24N3O9P/c1-10-16(24)13(12(7-19-10)9-30-31(27,28)29)8-20-21-18(2,17(25)26)6-11-3-4-14(22)15(23)5-11/h3-5,7,20-24H,6,8-9H2,1-2H3,(H,25,26)(H2,27,28,29)/t18-/m0/s1