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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H18F6N4O3.H3O4P
Molecular Weight 562.3568
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RETAGLIPTIN PHOSPHATE

SMILES

OP(O)(O)=O.COC(=O)C1=C2CN(CCN2C(=N1)C(F)(F)F)C(=O)C[C@H](N)CC3=C(F)C=C(F)C(F)=C3

InChI

InChIKey=SFNHOWDAQMIJPX-HNCPQSOCSA-N
InChI=1S/C19H18F6N4O3.H3O4P/c1-32-17(31)16-14-8-28(2-3-29(14)18(27-16)19(23,24)25)15(30)6-10(26)4-9-5-12(21)13(22)7-11(9)20;1-5(2,3)4/h5,7,10H,2-4,6,8,26H2,1H3;(H3,1,2,3,4)/t10-;/m1./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
RETAGLIPTIN PHOSPHATE
Common Name English
SP-2086(H3PO4)
Code English
IMIDAZO(1,5-A)PYRAZINE-1-CARBOXYLIC ACID, 7-((3R)-3-AMINO-1-OXO-4-(2,4,5-TRIFLUOROPHENYL)BUTYL)-5,6,7,8-TETRAHYDRO-3-(TRIFLUOROMETHYL)-, METHYL ESTER, PHOSPHATE (1:1)
Common Name English
Code System Code Type Description
PUBCHEM
49820554
Created by admin on Fri Dec 15 17:26:38 UTC 2023 , Edited by admin on Fri Dec 15 17:26:38 UTC 2023
PRIMARY
CAS
1256756-88-3
Created by admin on Fri Dec 15 17:26:38 UTC 2023 , Edited by admin on Fri Dec 15 17:26:38 UTC 2023
PRIMARY
FDA UNII
24NZ3UE3DJ
Created by admin on Fri Dec 15 17:26:38 UTC 2023 , Edited by admin on Fri Dec 15 17:26:38 UTC 2023
PRIMARY