SITAGLIPTIN HYDROCHLORIDE

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Details

Stereochemistry	ABSOLUTE
Molecular Formula	C16H15F6N5O.ClH
Molecular Weight	443.775
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of SITAGLIPTIN HYDROCHLORIDE

Structure Search

SMILES

Cl.N[C@@H](CC(=O)N1CCN2C(C1)=NN=C2C(F)(F)F)CC3=C(F)C=C(F)C(F)=C3

InChI

InChIKey=PNXSHNOORJKXDW-SBSPUUFOSA-N

InChI=1S/C16H15F6N5O.ClH/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;/h4,6,9H,1-3,5,7,23H2;1H/t9-;/m1./s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

SITAGLIPTIN HYDROCHLORIDE

Common Name

English

1,2,4-TRIAZOLO(4,3-A)PYRAZINE, 7-((3R)-3-AMINO-1-OXO-4-(2,4,5-TRIFLUOROPHENYL)BUTYL)-5,6,7,8-TETRAHYDRO-3-(TRIFLUOROMETHYL)-, MONOHYDROCHLORIDE

Systematic Name

English

1-BUTANONE, 3-AMINO-1-(5,6-DIHYDRO-3-(TRIFLUOROMETHYL)-1,2,4-TRIAZOLO(4,3-A)PYRAZIN-7(8H)-YL)-4-(2,4,5-TRIFLUOROPHENYL)-, HYDROCHLORIDE (1:1), (3R)-

Systematic Name

English

Code System Code Type Description

CAS

486459-71-6

Created by admin on Sat Dec 16 10:37:05 UTC 2023 , Edited by admin on Sat Dec 16 10:37:05 UTC 2023

PRIMARY

FDA UNII

IEL0A0OS7E

Created by admin on Sat Dec 16 10:37:05 UTC 2023 , Edited by admin on Sat Dec 16 10:37:05 UTC 2023

PRIMARY

PUBCHEM

11476287

Created by admin on Sat Dec 16 10:37:05 UTC 2023 , Edited by admin on Sat Dec 16 10:37:05 UTC 2023

PRIMARY

CAS

1000153-09-2

Created by admin on Sat Dec 16 10:37:05 UTC 2023 , Edited by admin on Sat Dec 16 10:37:05 UTC 2023

NON-SPECIFIC STOICHIOMETRY

SMS_ID

100000174577

Created by admin on Sat Dec 16 10:37:05 UTC 2023 , Edited by admin on Sat Dec 16 10:37:05 UTC 2023

PRIMARY

ACTIVE MOIETY


					QFP0P1DV7Z

SUBSTANCE RECORD


					IEL0A0OS7E

SITAGLIPTIN HYDROCHLORIDE