Nombre del analito

Imazethapyr metabolite 1

Número CAS

154519-94-5

Fórmula molecular

C21 H29 N3 O9

Peso molecular

467.47

Masa exacta

467.19

SMILES

CC(C)C1(C)N=C(NC1=O)c2ncc(cc2C(=O)O)C(C)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O

InChI

InChI=1S/C21H29N3O9/c1-8(2)21(4)20(31)23-17(24-21)13-11(18(29)30)5-10(6-22-13)9(3)32-19-16(28)15(27)14(26)12(7-25)33-19/h5-6,8-9,12,14-16,19,25-28H,7H2,1-4H3,(H,29,30)(H,23,24,31)/t9?,12-,14-,15+,16-,19-,21?/m1/s1

IUPAC

2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)-5-[1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]pyridine-3-carboxylic acid

Temperatura de envío

Room Temperature

País de origen

CANADA

Tipo de producto

Impurity

Formato del producto

Neat