Sitagliptin phosphate monohydrate

Sitagliptin phosphate monohydrate (MK-0431) is a potent inhibitor of DPP-IV with IC50 of 19 nM in Caco-2 cell extracts.

Trivial name MK-0431
Catalog Number S4002
Molecular Formula C16H15F6N5O.H3PO4.H2O
CAS# 654671-77-9
Inchi InChI=1S/C16H15F6N5O.H3O4P.H2O/c17-10-6-12(19)11(18)4-8(10)3-9(23)5-14(28)26-1-2-27-13(7-26)24-25-15(27)16(20,21)22;1-5(2,3)4;/h4,6,9H,1-3,5,7,23H2;(H3,1,2,3,4);1H2/t9-;;/m1../s1
Inchi Key GQPYTJVDPQTBQC-KLQYNRQASA-N
SMILES C1CN2C(=NN=C2C(F)(F)F)CN1C(=O)CC(CC3=CC(=C(C=C3F)F)F)N.O.OP(=O)(O)O
Size 10mM/1mL
Supplier Page http://www.selleckchem.com/products/sitagliptin-phosphate-monohydrate.html
Additional Information https://file.selleck.cn/downloads/struct/sitagliptin-phosphate-monohydrate-chemical-structure-s4002.gif