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

Details

Stereochemistry ABSOLUTE
Molecular Formula C13H17NO4
Molecular Weight 251.2784
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-((2,2-DIMETHYLPROPANOYL)AMINO)-2-(4-HYDROXYPHENYL)ACETIC ACID, (2R)-

SMILES

CC(C)(C)C(=O)N[C@@H](C(O)=O)C1=CC=C(O)C=C1

InChI

InChIKey=BSXQHKOBFTYRJX-SNVBAGLBSA-N
InChI=1S/C13H17NO4/c1-13(2,3)12(18)14-10(11(16)17)8-4-6-9(15)7-5-8/h4-7,10,15H,1-3H3,(H,14,18)(H,16,17)/t10-/m1/s1

HIDE SMILES / InChI

Molecular Formula C13H17NO4
Molecular Weight 251.2784
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 05:49:26 UTC 2023
Edited
by admin
on Sat Dec 16 05:49:26 UTC 2023
Record UNII
27TEW12TQY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-((2,2-DIMETHYLPROPANOYL)AMINO)-2-(4-HYDROXYPHENYL)ACETIC ACID, (2R)-
Common Name English
AMOXICILLIN RELATED COMPOUND H [USP-RS]
Common Name English
AMOXICILLIN TRIHYDRATE IMPURITY H [EP IMPURITY]
Common Name English
AMOXICILLIN SODIUM IMPURITY H [EP IMPURITY]
Common Name English
BENZENEACETIC ACID, .ALPHA.-((2,2-DIMETHYL-1-OXOPROPYL)AMINO)-4-HYDROXY-, (R)-
Common Name English
(2R)-2-((2,2-DIMETHYLPROPANOYL)AMINO)-2-(4-HYDROXYPHENYL)ACETIC ACID
Systematic Name English
BENZENEACETIC ACID, .ALPHA.-((2,2-DIMETHYL-1-OXOPROPYL)AMINO)-4-HYDROXY-, (.ALPHA.R)-
Common Name English
Code System Code Type Description
RS_ITEM_NUM
1031616
Created by admin on Sat Dec 16 05:49:26 UTC 2023 , Edited by admin on Sat Dec 16 05:49:26 UTC 2023
PRIMARY
EPA CompTox
DTXSID20174595
Created by admin on Sat Dec 16 05:49:26 UTC 2023 , Edited by admin on Sat Dec 16 05:49:26 UTC 2023
PRIMARY
CAS
205826-86-4
Created by admin on Sat Dec 16 05:49:26 UTC 2023 , Edited by admin on Sat Dec 16 05:49:26 UTC 2023
PRIMARY
FDA UNII
27TEW12TQY
Created by admin on Sat Dec 16 05:49:26 UTC 2023 , Edited by admin on Sat Dec 16 05:49:26 UTC 2023
PRIMARY
PUBCHEM
71587634
Created by admin on Sat Dec 16 05:49:26 UTC 2023 , Edited by admin on Sat Dec 16 05:49:26 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP