Nombre del analito

1-beta-D-Glucopyranuronosyl-3-[1-hydroxy-4-(methylnitrosoamino)butyl]pridinium Inner Salt

Fórmula molecular

C16H23N3O8

Peso molecular

386.38

Masa exacta

386.16

SMILES

OC([C@H]1O[C@@H]([N+]2=CC=CC(C(O)CCCN(N=O)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O)=O

InChI

InChI=1S/C16H24N3O8/c1-18(17-26)6-3-5-10(20)9-4-2-7-19(8-9)15-13(23)11(21)12(22)14(27-15)16(24)25/h2,4,7-8,10-15,20-23H,3,5-6H2,1H3,(H,24,25)/t10?,11-,12-,13+,14-,15+/m0/s1

IUPAC

1-((2R,3R,4S,5S,6S)-6-carboxy-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)-3-(1-hydroxy-4-(methyl(nitroso)amino)butyl)pyridin-1-ium

Temperatura de envío

Room Temperature

País de origen

CANADA

Tipo de producto

Contaminant

Formato del producto

Neat