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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H21N3O3.C2H4O2
Molecular Weight 411.451
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Phenylalanyltryptophan acetate

SMILES

CC(O)=O.N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC2=CNC3=CC=CC=C23)C(O)=O

InChI

InChIKey=ZRNCKEYXEOATTP-AKXYIILFSA-N
InChI=1S/C20H21N3O3.C2H4O2/c21-16(10-13-6-2-1-3-7-13)19(24)23-18(20(25)26)11-14-12-22-17-9-5-4-8-15(14)17;1-2(3)4/h1-9,12,16,18,22H,10-11,21H2,(H,23,24)(H,25,26);1H3,(H,3,4)/t16-,18-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C2H4O2
Molecular Weight 60.052
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C20H21N3O3
Molecular Weight 351.399
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 Sat Dec 16 20:21:30 GMT 2023
Edited
by admin
on Sat Dec 16 20:21:30 GMT 2023
Record UNII
3YTQ76VBZ2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Phenylalanyltryptophan acetate
Systematic Name English
L-Tryptophan, N-L-phenylalanyl-, monoacetate
Systematic Name English
Code System Code Type Description
CAS
66866-38-4
Created by admin on Sat Dec 16 20:21:30 GMT 2023 , Edited by admin on Sat Dec 16 20:21:30 GMT 2023
PRIMARY
FDA UNII
3YTQ76VBZ2
Created by admin on Sat Dec 16 20:21:30 GMT 2023 , Edited by admin on Sat Dec 16 20:21:30 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE