U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry EPIMERIC
Molecular Formula C15H21N3O4S
Molecular Weight 339.41
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(((R)-2-AMINO-2-(4-HYDROXYPHENYL)ACETAMIDO)METHYL(-5,5-DIMETHYLTHIAZOLIDINE-4-CARBOXYLIC ACID, (4S)-

SMILES

CC1(C)SC(CNC(=O)[C@H](N)C2=CC=C(O)C=C2)N[C@H]1C(O)=O

InChI

InChIKey=HLJHSXSJKLJNKE-SAIIYOCFSA-N
InChI=1S/C15H21N3O4S/c1-15(2)12(14(21)22)18-10(23-15)7-17-13(20)11(16)8-3-5-9(19)6-4-8/h3-6,10-12,18-19H,7,16H2,1-2H3,(H,17,20)(H,21,22)/t10?,11-,12+/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H21N3O4S
Molecular Weight 339.41
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 2 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 12:41:22 UTC 2023
Edited
by admin
on Thu Jul 06 12:41:22 UTC 2023
Record UNII
9OSM52GH6L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(((R)-2-AMINO-2-(4-HYDROXYPHENYL)ACETAMIDO)METHYL(-5,5-DIMETHYLTHIAZOLIDINE-4-CARBOXYLIC ACID, (4S)-
Common Name English
AMOXICILLIN RELATED COMPOUND E
Common Name English
(4S)-2-(((R)-2-AMINO-2-(4-HYDROXYPHENYL)ACETAMIDO)METHYL(-5,5-DIMETHYLTHIAZOLIDINE-4-CARBOXYLIC ACID
Common Name English
AMOXICILLIN SODIUM IMPURITY E [EP IMPURITY]
Common Name English
AMOXICILLIN TRIHYDRATE IMPURITY E [EP IMPURITY]
Common Name English
(2RS,4S)-2-((((2R)-2-AMINO-2-(4-HYDROXYPHENYL)ACETYL)AMINO)METHYL)-5,5-DIMETHYLTHIAZOLIDINE-4-CARBOXYLIC ACID
Systematic Name English
4-THIAZOLIDINECARBOXYLIC ACID, 2-((((2R)-2-AMINO-2-(4-HYDROXYPHENYL)ACETYL)AMINO)METHYL)-5,5-DIMETHYL-, (4S)-
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID10159477
Created by admin on Thu Jul 06 12:41:22 UTC 2023 , Edited by admin on Thu Jul 06 12:41:22 UTC 2023
PRIMARY
CAS
1356020-01-3
Created by admin on Thu Jul 06 12:41:22 UTC 2023 , Edited by admin on Thu Jul 06 12:41:22 UTC 2023
PRIMARY
FDA UNII
9OSM52GH6L
Created by admin on Thu Jul 06 12:41:22 UTC 2023 , Edited by admin on Thu Jul 06 12:41:22 UTC 2023
PRIMARY
PUBCHEM
71313270
Created by admin on Thu Jul 06 12:41:22 UTC 2023 , Edited by admin on Thu Jul 06 12:41:22 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP