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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H17N5O7S3.ClH
Molecular Weight 560.024
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of CEFTIOFUR HYDROCHLORIDE

SMILES

Cl.[H][C@]12SCC(CSC(=O)C3=CC=CO3)=C(N1C(=O)[C@H]2NC(=O)C(=N/OC)\C4=CSC(N)=N4)C(O)=O

InChI

InChIKey=KEQFDTJEEQKVLM-JUODUXDSSA-N
InChI=1S/C19H17N5O7S3.ClH/c1-30-23-11(9-7-34-19(20)21-9)14(25)22-12-15(26)24-13(17(27)28)8(5-32-16(12)24)6-33-18(29)10-3-2-4-31-10;/h2-4,7,12,16H,5-6H2,1H3,(H2,20,21)(H,22,25)(H,27,28);1H/b23-11-;/t12-,16-;/m1./s1

HIDE SMILES / InChI
Molecular Formula C19H17N5O7S3
Molecular Weight 523.563
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 1
Optical Activity UNSPECIFIED
Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
86413
Substance Class Chemical
Created
by admin
on Fri Dec 15 16:07:15 UTC 2023
Edited
by admin
on Fri Dec 15 16:07:15 UTC 2023
Record UNII
6822A07436
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CEFTIOFUR HYDROCHLORIDE
GREEN BOOK   MART.   USAN  
USAN  
Official Name English
U-64279A
Code English
CEFTIOFUR HYDROCHLORIDE [MART.]
Common Name English
CEFTIOFUR MONOHYDROCHLORIDE [MI]
Common Name English
CEFTIOFUR HYDROCHLORIDE [USAN]
Common Name English
CEFTIOFUR HYDROCHLORIDE [GREEN BOOK]
Common Name English
CEFTIOFUR MONOHYDROCHLORIDE
MI  
Common Name English
CEFTIOFUR HYDROCHLORIDE [USP MONOGRAPH]
Common Name English
NSC-759845
Code English
5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID, 7-(((2-AMINO-4-THIAZOLYL)(METHOXYIMINO)ACETYL)AMINO)-3-(((2-FURANYLCARBONYL)THIO)METHYL)-8-OXO-, MONOHYDROCHLORIDE, (6R-(6.ALPHA.,7.BETA.(Z)))-
Common Name English
(6R,7R)-7-(2-(2-AMINO-4-THIAZOLYL)GLYOXYLAMIDO)-3-(MERCAPTOMETHYL)-8-OXO-5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID, 7(SUP 2)-(Z)-(O-METHYLOXIME), 2-FUROATE (ESTER), MONOHYDROCHLORIDE
Common Name English
CEFTIOFUR HCL
Common Name English
CEFTIOFUR HYDROCHLORIDE [USP-RS]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C357
Created by admin on Fri Dec 15 16:07:15 UTC 2023 , Edited by admin on Fri Dec 15 16:07:15 UTC 2023
CFR 21 CFR 522.313B
Created by admin on Fri Dec 15 16:07:15 UTC 2023 , Edited by admin on Fri Dec 15 16:07:15 UTC 2023
Code System Code Type Description
USAN
Y-85
Created by admin on Fri Dec 15 16:07:15 UTC 2023 , Edited by admin on Fri Dec 15 16:07:15 UTC 2023
PRIMARY
ChEMBL
CHEMBL222913
Created by admin on Fri Dec 15 16:07:15 UTC 2023 , Edited by admin on Fri Dec 15 16:07:15 UTC 2023
PRIMARY
DRUG BANK
DBSALT001643
Created by admin on Fri Dec 15 16:07:15 UTC 2023 , Edited by admin on Fri Dec 15 16:07:15 UTC 2023
PRIMARY
PUBCHEM
9937686
Created by admin on Fri Dec 15 16:07:15 UTC 2023 , Edited by admin on Fri Dec 15 16:07:15 UTC 2023
PRIMARY
RS_ITEM_NUM
1098071
Created by admin on Fri Dec 15 16:07:15 UTC 2023 , Edited by admin on Fri Dec 15 16:07:15 UTC 2023
PRIMARY
EVMPD
SUB180294
Created by admin on Fri Dec 15 16:07:15 UTC 2023 , Edited by admin on Fri Dec 15 16:07:15 UTC 2023
PRIMARY
SMS_ID
100000166239
Created by admin on Fri Dec 15 16:07:15 UTC 2023 , Edited by admin on Fri Dec 15 16:07:15 UTC 2023
PRIMARY
RXCUI
1311520
Created by admin on Fri Dec 15 16:07:15 UTC 2023 , Edited by admin on Fri Dec 15 16:07:15 UTC 2023
PRIMARY RxNorm
MERCK INDEX
m3221
Created by admin on Fri Dec 15 16:07:15 UTC 2023 , Edited by admin on Fri Dec 15 16:07:15 UTC 2023
PRIMARY Merck Index
NCI_THESAURUS
C76174
Created by admin on Fri Dec 15 16:07:15 UTC 2023 , Edited by admin on Fri Dec 15 16:07:15 UTC 2023
PRIMARY
EPA CompTox
DTXSID101034300
Created by admin on Fri Dec 15 16:07:15 UTC 2023 , Edited by admin on Fri Dec 15 16:07:15 UTC 2023
PRIMARY
NSC
759845
Created by admin on Fri Dec 15 16:07:15 UTC 2023 , Edited by admin on Fri Dec 15 16:07:15 UTC 2023
PRIMARY
FDA UNII
6822A07436
Created by admin on Fri Dec 15 16:07:15 UTC 2023 , Edited by admin on Fri Dec 15 16:07:15 UTC 2023
PRIMARY
DAILYMED
6822A07436
Created by admin on Fri Dec 15 16:07:15 UTC 2023 , Edited by admin on Fri Dec 15 16:07:15 UTC 2023
PRIMARY
MESH
C053503
Created by admin on Fri Dec 15 16:07:15 UTC 2023 , Edited by admin on Fri Dec 15 16:07:15 UTC 2023
PRIMARY
CAS
103980-44-5
Created by admin on Fri Dec 15 16:07:15 UTC 2023 , Edited by admin on Fri Dec 15 16:07:15 UTC 2023
PRIMARY
Related Record Type Details
Structure of CEFTIOFUR
PARENT -> SALT/SOLVATE
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Structure of 2-FUROIC ACID
IMPURITY -> PARENT
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Structure of S-(4-HYDROXY-5-OXO-2,5-DIHYDROTHIOPHEN-3-YL)METHYL FURAN-2- CARBOTHIOATE
IMPURITY -> PARENT
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Structure of N-DEACYL CEFTIOFUR
IMPURITY -> PARENT
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Structure of N-TRITYL CEFTIOFUR OXIME
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
Structure of 7-AMINOCEPHALOSPORANIC ACID
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
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Structure of CEFOTAXIME
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
Structure of (6R,7R)-7-((E)-2-(2-AMINOTHIAZOL-4-YL)-2-(METHOXYIMINO)ACETAMIDO)-3-((FURAN-2-CARBONYLTHIO)METHYL)-8-OXO-5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLIC ACID
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
Structure of CEFTIOFUR OXIME ETHYL ESTER
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
Structure of CEFTIOFUR AMIDE DIMER
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
Related Record Type Details
Structure of CEFTIOFUR
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