BIOPEP-UWM: Report

ID 553
Name N-acetylisoleucine - kokumi
sequence
{C2:0}I

Function:
Kokumi
 
Number of residues
2
Activity code
ko
Activity :
kokumi
Chemical mass 173.2090 Monoisotopic mass 173.1048
EC50 :
0.00 µM



Bibliographic data:
Authors
Brehm L., Junger M., Frank O., Hofmann T.
Title
Discovery of a thiamine-derived taste enhancer in process flavors. J. Agric. Food Chem., 67, 5857–5865, 2019
Year Source
2019 Journal



Additional information:
BIOPEP-UWM database of sensory peptides and amino acids


SMILES: CC(=O)N[C@@]([H])([C@]([H])(CC)C)C(=O)O

InChI=1S/C8H15NO3/c1-4-5(2)7(8(11)12)9-6(3)10/h5,7H,4H2,1-3H3,(H,9,10)(H,11,12)/t5-,7-/m0/s1

InChIKey=JDTWZSUNGHMMJM-FSPLSTOPSA-N


{C2:0} - N-terminal acetic acid, BIOPEP-UWM repository of amino acids and modifications ID 130





Database reference:
BRENDA: Ligand N-alpha-acetyl-L-isoleucine

CAS: Registry No 3077-46-1

ChEBI: ID 21555

ChEMBL: ID CHEMBL1221841

Chemspider: ID 5397969

ECHA: ID 221-364-9

EPA CompTox: ID DTXSID101314843

HMDB: ID HMDB0061684

J-GLOBAL: ID 200907012645841857

Metabolights: ID MTBLC21555

Metabolomics Workbench: ID 156671

Nikkaji: ID J102.445K

PubChem: CID 7036275

SureChEMBL: ID SCHEMBL359065

UNII: ID P9CL0Y0BVZ

ZINC: ID ZINC000003123568