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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H21FN6O.CH4O3S
Molecular Weight 416.471
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MELOGLIPTIN MESYLATE

SMILES

CS(O)(=O)=O.F[C@H]1C[C@@H](C#N)N(C1)C(=O)CN[C@@H]2CC[C@H](CN3C=NC=N3)C2

InChI

InChIKey=IAWFHPXSNMKWIL-QVYXHAGSSA-N
InChI=1S/C15H21FN6O.CH4O3S/c16-12-4-14(5-17)22(8-12)15(23)6-19-13-2-1-11(3-13)7-21-10-18-9-20-21;1-5(2,3)4/h9-14,19H,1-4,6-8H2;1H3,(H,2,3,4)/t11-,12-,13+,14-;/m0./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
MELOGLIPTIN MESYLATE
Common Name English
(1R,3S)-N-(2-((2S,4S)-2-ETHYNYL-4-FLUOROPYRROLIDIN-1-YL)-2-OXOETHYL)-3-(1H-1,2,4-TRIAZOL-1-YLMETHYL)CYCLOPENTANAMINE METHANESULPHONATE
Systematic Name English
1-PYRROLIDINEETHANAMINE, 2-ETHYNYL-4-FLUORO-.BETA.-OXO-N-((1R,3S)-3-(1H-1,2,4-TRIAZOL-1-YLMETHYL)CYCLOPENTYL)-, (2S,4S)-, METHANESULPHONATE (1:1)
Systematic Name English
Code System Code Type Description
FDA UNII
94YJM64V3O
Created by admin on Fri Dec 15 16:56:12 UTC 2023 , Edited by admin on Fri Dec 15 16:56:12 UTC 2023
PRIMARY
EPA CompTox
DTXSID30235989
Created by admin on Fri Dec 15 16:56:12 UTC 2023 , Edited by admin on Fri Dec 15 16:56:12 UTC 2023
PRIMARY
SMS_ID
300000042470
Created by admin on Fri Dec 15 16:56:12 UTC 2023 , Edited by admin on Fri Dec 15 16:56:12 UTC 2023
PRIMARY
PUBCHEM
46241183
Created by admin on Fri Dec 15 16:56:12 UTC 2023 , Edited by admin on Fri Dec 15 16:56:12 UTC 2023
PRIMARY
CAS
869368-93-4
Created by admin on Fri Dec 15 16:56:12 UTC 2023 , Edited by admin on Fri Dec 15 16:56:12 UTC 2023
PRIMARY