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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H16N2O6S2
Molecular Weight 384.427
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DECARBAMYLCEFOXITIN

SMILES

[H][C@]12SCC(CO)=C(N1C(=O)[C@]2(NC(=O)CC3=CC=CS3)OC)C(O)=O

InChI

InChIKey=ZTFUMAYWSRFLRO-CABCVRRESA-N
InChI=1S/C15H16N2O6S2/c1-23-15(16-10(19)5-9-3-2-4-24-9)13(22)17-11(12(20)21)8(6-18)7-25-14(15)17/h2-4,14,18H,5-7H2,1H3,(H,16,19)(H,20,21)/t14-,15+/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H16N2O6S2
Molecular Weight 384.427
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:26:00 GMT 2023
Edited
by admin
on Fri Dec 15 16:26:00 GMT 2023
Record UNII
JL7RQB0I8T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DECARBAMYLCEFOXITIN
Common Name English
CEFOXITIN SODIUM IMPURITY A [EP IMPURITY]
Common Name English
(6R,7S)-3-(Hydroxymethyl)-7-methoxy-8-oxo-7-[[2-(2-thienyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Systematic Name English
5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID, 3-(HYDROXYMETHYL)-7-METHOXY-8-OXO-7-((2-(2-THIENYL)ACETYL)AMINO)-, (6R,7S)-
Systematic Name English
Decarbamoylcefoxitin
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
259-108-3
Created by admin on Fri Dec 15 16:26:00 GMT 2023 , Edited by admin on Fri Dec 15 16:26:00 GMT 2023
PRIMARY
EPA CompTox
DTXSID00202704
Created by admin on Fri Dec 15 16:26:00 GMT 2023 , Edited by admin on Fri Dec 15 16:26:00 GMT 2023
PRIMARY
FDA UNII
JL7RQB0I8T
Created by admin on Fri Dec 15 16:26:00 GMT 2023 , Edited by admin on Fri Dec 15 16:26:00 GMT 2023
PRIMARY
PUBCHEM
23620315
Created by admin on Fri Dec 15 16:26:00 GMT 2023 , Edited by admin on Fri Dec 15 16:26:00 GMT 2023
PRIMARY
CAS
54333-94-7
Created by admin on Fri Dec 15 16:26:00 GMT 2023 , Edited by admin on Fri Dec 15 16:26:00 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY