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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H13NO7.2Na
Molecular Weight 341.2244
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DISODIUM MALYL TYROSINATE

SMILES

[Na+].[Na+].O[C@@H](CC([O-])=O)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C([O-])=O

InChI

InChIKey=JJQLINSJHXHGPL-BZDVOYDHSA-L
InChI=1S/C13H15NO7.2Na/c15-8-3-1-7(2-4-8)5-9(13(20)21)14-12(19)10(16)6-11(17)18;;/h1-4,9-10,15-16H,5-6H2,(H,14,19)(H,17,18)(H,20,21);;/q;2*+1/p-2/t9-,10-;;/m0../s1

HIDE SMILES / InChI

Molecular Formula Na
Molecular Weight 22.98976928
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C13H13NO7
Molecular Weight 295.2448
Charge -2
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 Mon Mar 31 18:12:42 GMT 2025
Edited
by admin
on Mon Mar 31 18:12:42 GMT 2025
Record UNII
865390F26I
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DISODIUM MALYL TYROSINATE
INCI  
INCI  
Official Name English
L-TYROSINE, N-((2S)-3-CARBOXY-2-HYDROXY-1-OXOPROPYL)-, DISODIUM SALT
Preferred Name English
L-TYROSINE, N-(3-CARBOXY-2-HYDROXY-1-OXOPROPYL)-, DISODIUM SALT, (S)-
Common Name English
L-TYROSINE, N-((2S)-3-CARBOXY-2-HYDROXY-1-OXOPROPYL)-, SODIUM SALT (1:2)
Common Name English
Code System Code Type Description
FDA UNII
865390F26I
Created by admin on Mon Mar 31 18:12:42 GMT 2025 , Edited by admin on Mon Mar 31 18:12:42 GMT 2025
PRIMARY
PUBCHEM
71587464
Created by admin on Mon Mar 31 18:12:42 GMT 2025 , Edited by admin on Mon Mar 31 18:12:42 GMT 2025
PRIMARY
CAS
126139-79-5
Created by admin on Mon Mar 31 18:12:42 GMT 2025 , Edited by admin on Mon Mar 31 18:12:42 GMT 2025
PRIMARY
EPA CompTox
DTXSID80155087
Created by admin on Mon Mar 31 18:12:42 GMT 2025 , Edited by admin on Mon Mar 31 18:12:42 GMT 2025
PRIMARY