(2S,4R)-2-[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: (2S,4R)-2-[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]-1,3-thiazolidine-4-carboxylic acid Openeye Name: (2S,4R)-2-[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]thiazolidine-4-carboxylic acid CAS Name: (2S,4R)-2-[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridinyl]-4-thiazolidinecarboxylic acid IUPAC Name: (2S,4R)-2-[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]-1,3-thiazolidine-4-carboxylic acid Traditional Name: (2S,4R)-2-[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]thiazolidine-4-carboxylic acid Formula: C11H15N2O7PS MolecularWeight: 350.284761

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C1O)C2NC(CS2)C(=O)O)COP(=O)(O)O

Isomeric SMILES

CC1=NC=C(C(=C1O)[C@H]2N[C@@H](CS2)C(=O)O)COP(=O)(O)O

InChI

InChI=1S/C11H15N2O7PS/c1-5-9(14)8(10-13-7(4-22-10)11(15)16)6(2-12-5)3-20-21(17,18)19/h2,7,10,13-14H,3-4H2,1H3,(H,15,16)(H2,17,18,19)/t7-,10-/m0/s1