BIOPEP-UWM: Report

ID 10400
Name Antioxidative peptide
sequence
{C3:1(2E)[3ph;6OH;7OH]}HH~
Function:
Antioxidative
 
Number of residues
3
Activity code
ao
Activity :
antioxidative
Chemical mass 453.4503 Monoisotopic mass 453.1756
EC50 :
0.00 µM


Bibliographic data:
Authors
Seo H.-S., Kwak S.-Y., Lee Y.-S.
Title
Antioxidative activities of histidine containing caffeic acid-dipeptides. Bioorg. Med. Chem. Lett., 20, 4266–4272, 2010
Year Source
2010 Journal


Additional information:
BIOPEP-UWM database of bioactive peptides

SMILES: OC1=C(O)C=C(C=C1)/C=C/C(=O)N[C@@H](CC1=CN=C[NH]1)C(=O)N[C@@H](CC1=CN=C[NH]1)C(=O)N

InChI=1S/C21H23N7O5/c22-20(32)15(6-13-8-23-10-25-13)28-21(33)16(7-14-9-24-11-26-14)27-19(31)4-2-12-1-3-17(29)18(30)5-12/h1-5,8-11,15-16,29-30H,6-7H2,(H2,22,32)(H,23,25)(H,24,26)(H,27,31)(H,28,33)/b4-2+/t15-,16-/m0/s1

InChIKey=FQKQATWJGAMOCY-RXVFXRRZSA-N


{C3:1(2E)[3ph;6OH;7OH]} - caffeic acid; BIOPEP-UWM repository of amino acids and modifications ID 107
~ - C-terminal amide group (BIOPEP-UWM repository amino of acids and modifications: ID 75)


Database reference:
ChEMBL: ID CHEMBL1169836

ChemSpider: ID 25036051

PubChem: CID 49798560