ABL001-PEG-Acid

Analyte Name

ABL001-PEG-Acid

Molecular Formula

C29 H33 Cl F2 N6 O9

Molecular Weight

683.057

Accurate Mass

682.197

SMILES

O[C@H]1CN(C[C@@H]1C(=O)NCCOCCOCCOCC(=O)O)c2ncc(cc2c3ccn[nH]3)C(=O)Nc4ccc(OC(F)(F)Cl)cc4

InChI

InChI=1S/C29H33ClF2N6O9/c30-29(31,32)47-20-3-1-19(2-4-20)36-27(42)18-13-21(23-5-6-35-37-23)26(34-14-18)38-15-22(24(39)16-38)28(43)33-7-8-44-9-10-45-11-12-46-17-25(40)41/h1-6,13-14,22,24,39H,7-12,15-17H2,(H,33,43)(H,35,37)(H,36,42)(H,40,41)/t22-,24-/m0/s1

IUPAC

2-[2-[2-[2-[[(3S,4R)-1-[5-[[4-[chloro(difluoro)methoxy]phenyl]carbamoyl]-3-(1H-pyrazol-5-yl)pyridin-2-yl]-4-hydroxypyrrolidine-3-carbonyl]amino]ethoxy]ethoxy]ethoxy]acetic acid

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat