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Details

Stereochemistry ABSOLUTE
Molecular Formula C9H11NO2.C4H6O6
Molecular Weight 315.276
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of D-Phenylalanine, (2S,3S)-2,3-dihydroxybutanedioate

SMILES

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

InChI

InChIKey=JYTBFPUFHVJGTK-HORCDNLXSA-N
InChI=1S/C9H11NO2.C4H6O6/c10-8(9(11)12)6-7-4-2-1-3-5-7;5-1(3(7)8)2(6)4(9)10/h1-5,8H,6,10H2,(H,11,12);1-2,5-6H,(H,7,8)(H,9,10)/t8-;1-,2-/m10/s1

HIDE SMILES / InChI

Molecular Formula C9H11NO2
Molecular Weight 165.1891
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

Targets

Targets

Primary TargetPharmacologyConditionPotency
9.0 µM [EC50]
Substance Class Chemical
Created
by admin
on Wed Apr 02 19:34:23 GMT 2025
Edited
by admin
on Wed Apr 02 19:34:23 GMT 2025
Record UNII
Y7T6M8VUH4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
D-Phenylalanine, (2S,3S)-2,3-dihydroxybutanedioate (1:1)
Preferred Name English
D-Phenylalanine, (2S,3S)-2,3-dihydroxybutanedioate
Common Name English
Code System Code Type Description
CAS
762293-71-0
Created by admin on Wed Apr 02 19:34:23 GMT 2025 , Edited by admin on Wed Apr 02 19:34:23 GMT 2025
PRIMARY
FDA UNII
Y7T6M8VUH4
Created by admin on Wed Apr 02 19:34:23 GMT 2025 , Edited by admin on Wed Apr 02 19:34:23 GMT 2025
PRIMARY