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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H15Cl3N4O9S
Molecular Weight 569.757
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of N-(2,2,2-TRICHLOROACETYL)CEFUROXIME

SMILES

CO\N=C(/C(=O)N[C@H]1[C@H]2SCC(COC(=O)NC(=O)C(Cl)(Cl)Cl)=C(N2C1=O)C(O)=O)C3=CC=CO3

InChI

InChIKey=BGPGYDOAMAGXIO-HOYKSXRLSA-N
InChI=1S/C18H15Cl3N4O9S/c1-32-24-9(8-3-2-4-33-8)12(26)22-10-13(27)25-11(15(28)29)7(6-35-14(10)25)5-34-17(31)23-16(30)18(19,20)21/h2-4,10,14H,5-6H2,1H3,(H,22,26)(H,28,29)(H,23,30,31)/b24-9-/t10-,14-/m1/s1

HIDE SMILES / InChI

Molecular Formula C18H15Cl3N4O9S
Molecular Weight 569.757
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 21:37:40 GMT 2025
Edited
by admin
on Mon Mar 31 21:37:40 GMT 2025
Record UNII
Q2I223YL99
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-(2,2,2-TRICHLOROACETYL)CEFUROXIME
Common Name English
5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID, 7-((2-FURANYL(METHOXYIMINO)ACETYL)AMINO)-8-OXO-3-(((((TRICHLOROACETYL)AMINO)CARBONYL)OXY)METHYL)-, (6R-(6.ALPHA.,7.BETA.(Z)))-
Preferred Name English
(6R,7R)-7-(((Z)-2-(FURAN-2-YL)-2-(METHOXYIMINO)ACETYL)AMINO)-8-OXO-3-((((TRICHLOROACETYL)CARBAMOYL)OXY)METHYL)-5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID
Systematic Name English
CEFUROXIME SODIUM IMPURITY D [EP IMPURITY]
Common Name English
CEFUROXIME AXETIL IMPURITY C [EP IMPURITY]
Common Name English
Code System Code Type Description
CAS
76598-06-6
Created by admin on Mon Mar 31 21:37:40 GMT 2025 , Edited by admin on Mon Mar 31 21:37:40 GMT 2025
PRIMARY
EPA CompTox
DTXSID20227398
Created by admin on Mon Mar 31 21:37:40 GMT 2025 , Edited by admin on Mon Mar 31 21:37:40 GMT 2025
PRIMARY
FDA UNII
Q2I223YL99
Created by admin on Mon Mar 31 21:37:40 GMT 2025 , Edited by admin on Mon Mar 31 21:37:40 GMT 2025
PRIMARY
PUBCHEM
71587280
Created by admin on Mon Mar 31 21:37:40 GMT 2025 , Edited by admin on Mon Mar 31 21:37:40 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP