CLOXACILLIN CHLORO ISOMERS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H19N3O5S.CH3Cl
Molecular Weight	451.924
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCl.[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)C3=C(C)ON=C3C4=CC=CC=C4)C(O)=O

InChI

InChIKey=BAKWOCLQVPLVPO-SLINCCQESA-N

InChI=1S/C19H19N3O5S.CH3Cl/c1-9-11(12(21-27-9)10-7-5-4-6-8-10)15(23)20-13-16(24)22-14(18(25)26)19(2,3)28-17(13)22;1-2/h4-8,13-14,17H,1-3H3,(H,20,23)(H,25,26);1H3/t13-,14+,17-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	C19H19N3O5S
Molecular Weight	401.436
Charge	0
Count

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

Molecular Formula	CH3Cl
Molecular Weight	50.488
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:17:53 UTC 2023` Edited by `admin` on `Sat Dec 16 11:17:53 UTC 2023`
Record UNII	EKZ8N76PTN
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CLOXACILLIN CHLORO ISOMERS

Common Name

English

(2S,5R,6R)-6-(((3-(CHLOROPHENYL)-5-METHYLISOXAZOL-4-YL)CARBONYL)AMINO)-3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID

Systematic Name

English

OXACILLIN SODIUM MONOHYDRATE IMPURITY G [EP IMPURITY]

Common Name

English

Code System Code Type Description

PUBCHEM

156613694

Created by admin on Sat Dec 16 11:17:53 UTC 2023 , Edited by admin on Sat Dec 16 11:17:53 UTC 2023

PRIMARY

FDA UNII

EKZ8N76PTN

Created by admin on Sat Dec 16 11:17:53 UTC 2023 , Edited by admin on Sat Dec 16 11:17:53 UTC 2023

PRIMARY

Related Record Type Details


					G0V6C994Q5

OXACILLIN SODIUM

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

EP

Amount: