TEMOCILLIN

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	EPIMERIC
Molecular Formula	C16H18N2O7S2
Molecular Weight	414.453
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of TEMOCILLIN

Structure Search

SMILES

[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@]2(NC(=O)C(C(O)=O)C3=CSC=C3)OC)C(O)=O

InChI

InChIKey=BVCKFLJARNKCSS-DWPRYXJFSA-N

InChI=1S/C16H18N2O7S2/c1-15(2)9(12(22)23)18-13(24)16(25-3,14(18)27-15)17-10(19)8(11(20)21)7-4-5-26-6-7/h4-6,8-9,14H,1-3H3,(H,17,19)(H,20,21)(H,22,23)/t8?,9-,14+,16-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C16H18N2O7S2
Molecular Weight	414.453
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	3 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 17:03:03 UTC 2023` Edited by `admin` on `Sat Dec 16 17:03:03 UTC 2023`
Record UNII	03QB156W6I
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

TEMOCILLIN

Official Name

English

BRL-17421

Code

English

N-[(2S,5R,6S)-2-Carboxy-6-methoxy-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-6-yl]-3-thiophenemalonamic acid

Systematic Name

English

Temocillin [WHO-DD]

Common Name

English

temocillin [INN]

Common Name

English

TEMOCILLIN [MI]

Common Name

English

BRL 17421 FREE ACID

Code

English

TEMOCILLIN [MART.]

Common Name

English

TEMOCILLIN [USAN]

Common Name

English

4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID, 6-((CARBOXY-3-THIENYLACETYL)AMINO)-6-METHOXY-3,3-DIMETHYL-7-OXO-, (2S-(2.ALPHA.,5.ALPHA.,6.ALPHA.))-

Systematic Name

English

BRL-17421 FREE ACID

Code

English

Classification Tree Code System Code

WHO-VATC

QJ01CA17

Created by admin on Sat Dec 16 17:03:03 UTC 2023 , Edited by admin on Sat Dec 16 17:03:03 UTC 2023

NCI_THESAURUS

C1500

Created by admin on Sat Dec 16 17:03:03 UTC 2023 , Edited by admin on Sat Dec 16 17:03:03 UTC 2023

WHO-ATC

J01CA17

Created by admin on Sat Dec 16 17:03:03 UTC 2023 , Edited by admin on Sat Dec 16 17:03:03 UTC 2023

Code System Code Type Description

SMS_ID

100000082926

Created by admin on Sat Dec 16 17:03:03 UTC 2023 , Edited by admin on Sat Dec 16 17:03:03 UTC 2023

PRIMARY

EVMPD

SUB10886MIG

Created by admin on Sat Dec 16 17:03:03 UTC 2023 , Edited by admin on Sat Dec 16 17:03:03 UTC 2023

PRIMARY

NCI_THESAURUS

C76858

Created by admin on Sat Dec 16 17:03:03 UTC 2023 , Edited by admin on Sat Dec 16 17:03:03 UTC 2023

PRIMARY

PUBCHEM

171758

Created by admin on Sat Dec 16 17:03:03 UTC 2023 , Edited by admin on Sat Dec 16 17:03:03 UTC 2023

PRIMARY

USAN

X-27

Created by admin on Sat Dec 16 17:03:03 UTC 2023 , Edited by admin on Sat Dec 16 17:03:03 UTC 2023

PRIMARY

MERCK INDEX

m10550

Created by admin on Sat Dec 16 17:03:03 UTC 2023 , Edited by admin on Sat Dec 16 17:03:03 UTC 2023

PRIMARY

Merck Index

ChEMBL

CHEMBL1276310

Created by admin on Sat Dec 16 17:03:03 UTC 2023 , Edited by admin on Sat Dec 16 17:03:03 UTC 2023

PRIMARY

ECHA (EC/EINECS)

266-184-1

Created by admin on Sat Dec 16 17:03:03 UTC 2023 , Edited by admin on Sat Dec 16 17:03:03 UTC 2023

PRIMARY

WIKIPEDIA

TEMOCILLIN

Created by admin on Sat Dec 16 17:03:03 UTC 2023 , Edited by admin on Sat Dec 16 17:03:03 UTC 2023

PRIMARY

EPA CompTox

DTXSID201009398

Created by admin on Sat Dec 16 17:03:03 UTC 2023 , Edited by admin on Sat Dec 16 17:03:03 UTC 2023

PRIMARY

CHEBI

51817

Created by admin on Sat Dec 16 17:03:03 UTC 2023 , Edited by admin on Sat Dec 16 17:03:03 UTC 2023

PRIMARY

RXCUI

37775

Created by admin on Sat Dec 16 17:03:03 UTC 2023 , Edited by admin on Sat Dec 16 17:03:03 UTC 2023

PRIMARY

RxNorm

FDA UNII

03QB156W6I

Created by admin on Sat Dec 16 17:03:03 UTC 2023 , Edited by admin on Sat Dec 16 17:03:03 UTC 2023

PRIMARY

MESH

C031367

Created by admin on Sat Dec 16 17:03:03 UTC 2023 , Edited by admin on Sat Dec 16 17:03:03 UTC 2023

PRIMARY

INN

5097

Created by admin on Sat Dec 16 17:03:03 UTC 2023 , Edited by admin on Sat Dec 16 17:03:03 UTC 2023

PRIMARY

DRUG BANK

DB12343

Created by admin on Sat Dec 16 17:03:03 UTC 2023 , Edited by admin on Sat Dec 16 17:03:03 UTC 2023

PRIMARY

DRUG CENTRAL

2587

Created by admin on Sat Dec 16 17:03:03 UTC 2023 , Edited by admin on Sat Dec 16 17:03:03 UTC 2023

PRIMARY

CAS

66148-78-5

Created by admin on Sat Dec 16 17:03:03 UTC 2023 , Edited by admin on Sat Dec 16 17:03:03 UTC 2023

PRIMARY

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Comments:

Leads to resistance to the antibiotic.

Amount:

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ACTIVE MOIETY