CAS 350508-29-1: Pyridinium, 1-β-D-glucopyranuronosyl-3-[(1S)-1-hydroxy-4-(methylnitrosoamino)butyl]-, inner salt, stereoisomer

Description: Pyridinium, 1-β-D-glucopyranuronosyl-3-[(1S)-1-hydroxy-4-(methylnitrosoamino)butyl]-, inner salt, with CAS number 350508-29-1, is a complex organic compound characterized by its unique structural features. It contains a pyridinium moiety, which is a positively charged nitrogen-containing aromatic ring, and is linked to a glucopyranuronosyl group, indicating the presence of a sugar derivative that contributes to its solubility and potential biological activity. The compound also features a hydroxybutyl chain that is substituted with a methylnitrosoamino group, which is significant for its reactivity and potential interactions in biological systems. As an inner salt, it suggests that the compound has both acidic and basic functional groups, allowing for intramolecular interactions that can influence its stability and solubility in various solvents. The stereochemistry, indicated by the (1S) designation, implies specific spatial arrangements of atoms that can affect the compound's pharmacological properties and interactions with biological targets. Overall, this compound may have implications in medicinal chemistry and biochemistry, particularly in the study of drug design and development.

Formula: C₁₆H₂₃N₃O₈

InChI: InChI=1S/C16H23N3O8/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

InChI key: InChIKey=VSVYJUYJFLYYSI-UHFFFAOYSA-N

SMILES: O=NN(C)CCCC(O)C1=CC=C[N+](=C1)C2OC(C(=O)[O-])C(O)C(O)C2O

Synonyms:

• Pyridinium, 1-β-D-glucopyranuronosyl-3-[(1S)-1-hydroxy-4-(methylnitrosoamino)butyl]-, inner salt, stereoisomer

4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanol-N-b-D-glucuronide

CAS: 350508-29-1

4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanol N-β-D-Glucuronide

CAS: 350508-29-1

Stability Hygroscopic Applications A metabolite of NNAL. References Hecht, S.S., et al.: Chem. Res. Toxicol., …

• Formula: C₁₆H₂₃N₃O₈
• Color and Shape: Off-White To Yellow
• Molecular weight: 385.37

4-(Methylnitrosamino-d3)-1-(3-pyridyl)-1-butanol N-beta-D-Glucuronide (>80%)

CAS: 350508-29-1

Applications A deuterated metabolite of NNAL. References Hecht, S.S., et al.: Chem. Res. Toxicol., 14, …

• Formula: C₁₆H₂₀D₃N₃O₈
• Purity: >80%
• Color and Shape: Neat
• Molecular weight: 388.39

4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanol-N-b-D-glucuronide

CAS: 350508-29-1

Please enquire for more information about 4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanol-N-b-D-glucuronide including the price, delivery time and more detailed …

• Formula: C₁₆H₂₃N₃O₈
• Purity: Min. 95%
• Molecular weight: 385.37 g/mol