CEPHALOSPORIN C ZINC

Possibly Marketed Outside US

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C16H19N3O8S.Zn
Molecular Weight	478.811
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Zn++].[H][C@]12SCC(COC(C)=O)=C(N1C(=O)[C@H]2NC(=O)CCC[C@@H](N)C([O-])=O)C([O-])=O

InChI

InChIKey=TVMXJQZBKOMFQK-OOARYINLSA-L

InChI=1S/C16H21N3O8S.Zn/c1-7(20)27-5-8-6-28-14-11(13(22)19(14)12(8)16(25)26)18-10(21)4-2-3-9(17)15(23)24;/h9,11,14H,2-6,17H2,1H3,(H,18,21)(H,23,24)(H,25,26);/q;+2/p-2/t9-,11-,14-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	Zn
Molecular Weight	65.409
Charge	2
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C16H19N3O8S
Molecular Weight	413.402
Charge	-2
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Escherichia coli 82 Target ID: CHEMBL354 Sources: https://www.ncbi.nlm.nih.gov/pubmed/22483632	Inhibitor 8297
Bacterial penicillin-binding protein 233 Target ID: CHEMBL2354204 Sources: https://www.ncbi.nlm.nih.gov/pubmed/31265231 \| https://worldwide.espacenet.com/publicationDetails/biblio?DB=EPODOC&II=0&ND=3&adjacent=true&locale=en_EP&FT=D&date=20121206&CC=WO&NR=2012162814A1&KC=A1	Inhibitor 8297
Penicillin-binding protein 1A/1B 3 Target ID: P39793 Gene ID: 939044.0 Gene Symbol: ponA Target Organism: Bacillus subtilis (strain 168) Sources: https://www.ncbi.nlm.nih.gov/pubmed/7565098	Inhibitor 8297

PubMed

Title	Date	PubMed
Drugs as allergens: an immunoassay for detecting IgE antibodies to cephalosporins.	1990	2083978
beta-Lactam drug allergens: fine structural recognition patterns of cephalosporin-reactive IgE antibodies.	1996 Jul-Aug	9131470
Multichannel liquid chromatography-tandem mass spectrometry cocktail method for comprehensive substrate characterization of multidrug resistance-associated protein 4 transporter.	2007 Dec	17939016

Patents

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:59:04 GMT 2023` Edited by `admin` on `Sat Dec 16 09:59:04 GMT 2023`
Record UNII	7AX8Y0VD4W
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CEPHALOSPORIN C ZINC

Common Name

English

ZINC, (3-((ACETYLOXY)METHYL)-7-((5-AMINO-5-CARBOXY-1-OXOPENTYL)AMINO)-8-OXO-5-THIA-1-AZABICYCLO(4.2.0)OCT-2-ENE-2-CARBOXYLATO(2-))-

Systematic Name

English

ZINC CEPHALOSPORIN C

Common Name

English

Code System Code Type Description

PUBCHEM

11957494

Created by admin on Sat Dec 16 09:59:04 GMT 2023 , Edited by admin on Sat Dec 16 09:59:04 GMT 2023

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CAS

12567-06-5

Created by admin on Sat Dec 16 09:59:04 GMT 2023 , Edited by admin on Sat Dec 16 09:59:04 GMT 2023

PRIMARY

FDA UNII

7AX8Y0VD4W

Created by admin on Sat Dec 16 09:59:04 GMT 2023 , Edited by admin on Sat Dec 16 09:59:04 GMT 2023

PRIMARY

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