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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H13N5O5S2
Molecular Weight 395.414
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of CEFDINIR, (E)-

SMILES

[H][C@]12SCC(C=C)=C(N1C(=O)[C@H]2NC(=O)C(=N\O)\C3=CSC(N)=N3)C(O)=O

InChI

InChIKey=RTXOFQZKPXMALH-RWFJUVPESA-N
InChI=1S/C14H13N5O5S2/c1-2-5-3-25-12-8(11(21)19(12)9(5)13(22)23)17-10(20)7(18-24)6-4-26-14(15)16-6/h2,4,8,12,24H,1,3H2,(H2,15,16)(H,17,20)(H,22,23)/b18-7+/t8-,12-/m1/s1

HIDE SMILES / InChI

Molecular Formula C14H13N5O5S2
Molecular Weight 395.414
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 Sat Dec 16 07:42:45 UTC 2023
Edited
by admin
on Sat Dec 16 07:42:45 UTC 2023
Record UNII
61G2M33IGF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CEFDINIR, (E)-
Common Name English
5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID, 7-(((2-AMINO-4-THIAZOLYL)(HYDROXYIMINO)ACETYL)AMINO)-3-ETHENYL-8-OXO-, (6R-(6.ALPHA.,7.BETA.(E)))-
Common Name English
5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID, 7-(((2E)-2-(2-AMINO-4-THIAZOLYL)-2-(HYDROXYIMINO)ACETYL)AMINO)-3-ETHENYL-8-OXO-, (6R,7R)-
Common Name English
E-CEFDINIR
Common Name English
(6R ,7R )-7-((E)-2-(2-AMINOTHIAZOL-4-YL-)-2-(HYDROXYIMINO)ACETAMIDO)-8-OXO-3-VINYL-5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID
Common Name English
CEFDINIR, E-
Common Name English
CEFDINIR IMPURITY G
Common Name English
Code System Code Type Description
CAS
178601-88-2
Created by admin on Sat Dec 16 07:42:45 UTC 2023 , Edited by admin on Sat Dec 16 07:42:45 UTC 2023
PRIMARY
FDA UNII
61G2M33IGF
Created by admin on Sat Dec 16 07:42:45 UTC 2023 , Edited by admin on Sat Dec 16 07:42:45 UTC 2023
PRIMARY
PUBCHEM
6399253
Created by admin on Sat Dec 16 07:42:45 UTC 2023 , Edited by admin on Sat Dec 16 07:42:45 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
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