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Details

Stereochemistry ABSOLUTE
Molecular Formula C25H29ClO8
Molecular Weight 492.946
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of EMPAGLIFLOZIN ACETATE

SMILES

CC(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)C2=CC(CC3=CC=C(O[C@H]4CCOC4)C=C3)=C(Cl)C=C2

InChI

InChIKey=KGCZRQDTNDGABN-XSOWEEMTSA-N
InChI=1S/C25H29ClO8/c1-14(27)32-13-21-22(28)23(29)24(30)25(34-21)16-4-7-20(26)17(11-16)10-15-2-5-18(6-3-15)33-19-8-9-31-12-19/h2-7,11,19,21-25,28-30H,8-10,12-13H2,1H3/t19-,21+,22+,23-,24+,25-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
EMPAGLIFLOZIN ACETATE
Common Name English
MONOACETYL EMPAGLIFLOZIN
Common Name English
((2R,3S,4R,5R,6S)-6-(4-CHLORO-3-(4-(((S)-TETRAHYDROFURAN-3-YL)OXY)BENZYL)PHENYL)-3,4,5-TRIHYDROXYTETRAHYDRO-2H-PYRAN-2-YL)METHYL ACETATE
Common Name English
Code System Code Type Description
PUBCHEM
91827934
Created by admin on Sat Dec 16 18:22:19 GMT 2023 , Edited by admin on Sat Dec 16 18:22:19 GMT 2023
PRIMARY
FDA UNII
K43Z46NSR6
Created by admin on Sat Dec 16 18:22:19 GMT 2023 , Edited by admin on Sat Dec 16 18:22:19 GMT 2023
PRIMARY
CAS
2452301-09-4
Created by admin on Sat Dec 16 18:22:19 GMT 2023 , Edited by admin on Sat Dec 16 18:22:19 GMT 2023
PRIMARY