API reference

Sitagliptin phosphate

CAS number
654671-77-9
Molecular formula
C16H20F6N5O6P
Molecular weight
523.32 g/mol
Sitagliptin phosphate — 2D structure
2D structure (PubChem)

About this molecule

Sitagliptin Phosphate is the phosphate salt form of sitagliptin, an orally available, competitive, beta-amino acid-derived inhibitor of dipeptidyl peptidase 4 (DDP-4) with hypoglycemic activity. Sitagliptin may cause an increased risk in the development of pancreatitis.

Source: NCI Thesaurus (NCIt), via PubChem.

Identifiers

IUPAC name
(3R)-3-amino-1-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-4-(2,4,5-trifluorophenyl)butan-1-one;phosphoric acid;hydrate
InChIKey
GQPYTJVDPQTBQC-KLQYNRQASA-N
SMILES
C1CN2C(=NN=C2C(F)(F)F)CN1C(=O)C[C@@H](CC3=CC(=C(C=C3F)F)F)N.O.OP(=O)(O)O
Other CAS numbers recorded
654671-78-0
PubChem CID
11591741

Also known as

Sitagliptin phosphate monohydrate · Sitagliptin phosphate hydrate · Glactiv · sitagliptin monophosphate monohydrate · Sitagliptin monophosphate · Phosphate, Sitagliptin · Sitagliptin monophosphate anhydrous · Anhydrous, Sitagliptin Phosphate

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