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

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C13H20N2O4S
Molecular Weight	300.374
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

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

Structure Search

SMILES

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

InChI

InChIKey=PORWSLUULGTXGS-BKPPORCPSA-N

InChI=1S/C13H20N2O4S/c1-12(2,3)11(19)14-6-8(16)15-7(10(17)18)13(4,5)20-9(6)15/h6-7,9H,1-5H3,(H,14,19)(H,17,18)/t6-,7+,9-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C13H20N2O4S
Molecular Weight	300.374
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 06:43:52 UTC 2023` Edited by `admin` on `Sat Dec 16 06:43:52 UTC 2023`
Record UNII	6MM8IJ3O7L
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

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

Systematic Name

English

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

Common Name

English

AMPICILLIN TRIHYDRATE IMPURITY J [EP IMPURITY]

Common Name

English

4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID, 3,3-DIMETHYL-7-OXO-6-PIVALAMIDO-

Common Name

English

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

Common Name

English

AMPICILLIN, ANHYDROUS IMPURITY J [EP IMPURITY]

Common Name

English

Code System Code Type Description

CAS

6489-58-3

Created by admin on Sat Dec 16 06:43:53 UTC 2023 , Edited by admin on Sat Dec 16 06:43:53 UTC 2023

PRIMARY

EPA CompTox

DTXSID00215177

Created by admin on Sat Dec 16 06:43:53 UTC 2023 , Edited by admin on Sat Dec 16 06:43:53 UTC 2023

PRIMARY

FDA UNII

6MM8IJ3O7L

Created by admin on Sat Dec 16 06:43:53 UTC 2023 , Edited by admin on Sat Dec 16 06:43:53 UTC 2023

PRIMARY

PUBCHEM

209820

Created by admin on Sat Dec 16 06:43:53 UTC 2023 , Edited by admin on Sat Dec 16 06:43:53 UTC 2023

PRIMARY

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