CAS Number
Molecular Formula
C16H23N3O8
Product format
Neat
Molecular Weight
385.37
API Family
Synonyms
131119-04-5; 4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanol glucuronide; beta-D-Glucopyranosiduronic acid, 4-(methylnitrosoamino)-1-(3-pyridinyl)butyl; NNAL-glucuronide; NNAL-Gluc; Glucuronidated-NNAL; RefChem:97489; 4-(Methylnitrosamino)-1-(3-Pyridyl)-1-Butanol Beta-D-Glucuronide; 4-(Methylnitrosoamino)-1-(3-Pyridyl)-1-Butanol Beta-D-Glucuronide; 4-(Methylnitrosamino)-1-(3-Pyridyl)-1-(Beta-D-Glucopyranuronosyl)Butanol; (2S, 3S, 4S, 5R, 6R)-3, 4 and 5-trihydroxy-6-[4-[methyl(nitroso)amino]-1-pyridin-3-ylbutoxy]oxane-2-carboxylic acid; 4-(Methyl-D3-nitrosamino)-1-(3-pyridyl)-1-butanol-N-b-D-glucuronide; NNAL-O-glucuronide; 4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanol-N-b-D-glucuronide; NNAL-d3-N-b-glucuronide; SCHEMBL29824955; CHEBI:82591; DTXSID30927079; 4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanol N-b-D-Glucuronide; 4-((methylnitrosoamino)-1-(3-pyridyl)but-1-yl)beta-omega-glucosiduronic acid
Iupac Name
(2S, 3S, 4S, 5R, 6R)-3, 4 and 5-trihydroxy-6-[4-[methyl(nitroso)amino]-1-pyridin-3-ylbutoxy]oxane-2-carboxylic acid
InChI
InChI=1S/C16H23N3O8/c1-19(18-25)7-3-5-10(9-4-2-6-17-8-9)26-16-13(22)11(20)12(21)14(27-16)15(23)24/h2,4,6,8,10-14,16,20-22H,3,5,7H2,1H3,(H,23,24)/t10?,11-,12-,13+,14-,16+/m0/s1
