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Details

Stereochemistry ABSOLUTE
Molecular Formula C9H10ClNO2.C4H6O6
Molecular Weight 349.721
Optical Activity ( + )
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (S)-(+)-2-Chlorophenylglycine methyl ester tartrate

SMILES

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

InChI

InChIKey=FVKGOSHITUHKGR-YIDNRZKSSA-N
InChI=1S/C9H10ClNO2.C4H6O6/c1-13-9(12)8(11)6-4-2-3-5-7(6)10;5-1(3(7)8)2(6)4(9)10/h2-5,8H,11H2,1H3;1-2,5-6H,(H,7,8)(H,9,10)/t8-;1-,2-/m01/s1

HIDE SMILES / InChI

Molecular Formula C9H10ClNO2
Molecular Weight 199.634
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula C4H6O6
Molecular Weight 150.0868
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:22:00 GMT 2025
Edited
by admin
on Wed Apr 02 19:22:00 GMT 2025
Record UNII
59YKD7H69C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Benzeneacetic acid, ?-amino-2-chloro-, methyl ester, (?S)-, (2R,3R)-2,3-dihydroxybutanedioate (1:1)
Preferred Name English
(S)-(+)-2-Chlorophenylglycine methyl ester tartrate
Systematic Name English
Code System Code Type Description
FDA UNII
59YKD7H69C
Created by admin on Wed Apr 02 19:22:00 GMT 2025 , Edited by admin on Wed Apr 02 19:22:00 GMT 2025
PRIMARY
PUBCHEM
71307479
Created by admin on Wed Apr 02 19:22:00 GMT 2025 , Edited by admin on Wed Apr 02 19:22:00 GMT 2025
PRIMARY
CAS
141109-15-1
Created by admin on Wed Apr 02 19:22:00 GMT 2025 , Edited by admin on Wed Apr 02 19:22:00 GMT 2025
PRIMARY
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