BROBACTAM

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C8H10BrNO3S
Molecular Weight	280.139
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of BROBACTAM

Structure Search

SMILES

[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2Br)C(O)=O

InChI

InChIKey=DAVPSCAAXXVSFU-ALEPSDHESA-N

InChI=1S/C8H10BrNO3S/c1-8(2)4(7(12)13)10-5(11)3(9)6(10)14-8/h3-4,6H,1-2H3,(H,12,13)/t3-,4+,6-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C8H10BrNO3S
Molecular Weight	280.139
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 16:20:12 UTC 2023` Edited by `admin` on `Sat Dec 16 16:20:12 UTC 2023`
Record UNII	6I6JCF8EOE
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

BROBACTAM

Official Name

English

SULBACTAM RELATED COMPOUND D [USP IMPURITY]

Common Name

English

brobactam [INN]

Common Name

English

SULBACTAM SODIUM IMPURITY D [EP IMPURITY]

Common Name

English

(2S,5R,6R)-6-BROMO-3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID

Systematic Name

English

SULBACTAM RELATED COMPOUND D [USP-RS]

Common Name

English

SULBACTAM RELATED COMPOUND D

Common Name

English

6-BROMOPENICILLANIC ACID

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C260

Created by admin on Sat Dec 16 16:20:12 UTC 2023 , Edited by admin on Sat Dec 16 16:20:12 UTC 2023

Code System Code Type Description

CAS

26631-90-3

Created by admin on Sat Dec 16 16:20:12 UTC 2023 , Edited by admin on Sat Dec 16 16:20:12 UTC 2023

PRIMARY

FDA UNII

6I6JCF8EOE

Created by admin on Sat Dec 16 16:20:12 UTC 2023 , Edited by admin on Sat Dec 16 16:20:12 UTC 2023

PRIMARY

INN

5684

Created by admin on Sat Dec 16 16:20:12 UTC 2023 , Edited by admin on Sat Dec 16 16:20:12 UTC 2023

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NCI_THESAURUS

C72621

Created by admin on Sat Dec 16 16:20:12 UTC 2023 , Edited by admin on Sat Dec 16 16:20:12 UTC 2023

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EPA CompTox

DTXSID90181175

Created by admin on Sat Dec 16 16:20:12 UTC 2023 , Edited by admin on Sat Dec 16 16:20:12 UTC 2023

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MESH

C018008

Created by admin on Sat Dec 16 16:20:12 UTC 2023 , Edited by admin on Sat Dec 16 16:20:12 UTC 2023

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PUBCHEM

65754

Created by admin on Sat Dec 16 16:20:12 UTC 2023 , Edited by admin on Sat Dec 16 16:20:12 UTC 2023

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SMS_ID

100000088664

Created by admin on Sat Dec 16 16:20:12 UTC 2023 , Edited by admin on Sat Dec 16 16:20:12 UTC 2023

PRIMARY

ChEMBL

CHEMBL73622

Created by admin on Sat Dec 16 16:20:12 UTC 2023 , Edited by admin on Sat Dec 16 16:20:12 UTC 2023

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RS_ITEM_NUM

1623772

Created by admin on Sat Dec 16 16:20:12 UTC 2023 , Edited by admin on Sat Dec 16 16:20:12 UTC 2023

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ECHA (EC/EINECS)

247-856-3

Created by admin on Sat Dec 16 16:20:12 UTC 2023 , Edited by admin on Sat Dec 16 16:20:12 UTC 2023

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EVMPD

SUB05894MIG

Created by admin on Sat Dec 16 16:20:12 UTC 2023 , Edited by admin on Sat Dec 16 16:20:12 UTC 2023

PRIMARY

Related Record Type Details


					DKQ4T82YE6

SULBACTAM SODIUM

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

USP

Amount:


					S4TF6I2330

SULBACTAM

PARENT -> IMPURITY

Related Record Type Details


					6I6JCF8EOE

BROBACTAM

ACTIVE MOIETY