N-Nitroso Linaprazan glurate (N-nitrosoamine)Hydrochloride

Analyte Name

N-Nitroso Linaprazan glurate (N-nitrosoamine)Hydrochloride

Molecular Formula

C26 H31 N5 O6

Molecular Weight

509.55424

Accurate Mass

509.2274

SMILES

OC(CCCC(OCCNC(C(C=C1N(N=O)CC2=C(C)C=CC=C2C)=CN3C1=NC(C)=C3C)=O)=O)=O

InChI

InChI=1S/C26H31N5O6/c1-16-7-5-8-17(2)21(16)15-31(29-36)22-13-20(14-30-19(4)18(3)28-25(22)30)26(35)27-11-12-37-24(34)10-6-9-23(32)33/h5,7-8,13-14H,6,9-12,15H2,1-4H3,(H,27,35)(H,32,33)

IUPAC

5-[2-[[8-[(2,6-dimethylphenyl)methyl-nitroso-amino]-2,3-dimethyl-imidazo[1,2-a]pyridine-6-carbonyl]amino]ethoxy]-5-oxo-pentanoic acid

Country of Origin

CANADA

Product Format

Neat