BIOPEP-UWM: Report

ID 3126
Name fibronectin inhibitor
sequence
RGDS

Function:
Antithrombotic
 
Number of residues
4
Activity code
at
Activity :
antithrombotic
Chemical mass 433.4159 Monoisotopic mass 433.1915
EC50 :
0.00 µM



Bibliographic data:
Authors
Pierschbacher M. D., Ruoslahti E.
Title
Cell attachment activity of fibronectin can be duplicated by small synthetic fragment of the molecule. Nature, 309, 30-33, 1984
Year Source
1984 Journal



Additional information:
BIOPEP-UWM database of bioactive peptides

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

InChI=1S/C15H27N7O8/c16-7(2-1-3-19-15(17)18)12(27)20-5-10(24)21-8(4-11(25)26)13(28)22-9(6-23)14(29)30/h7-9,23H,1-6,16H2,(H,20,27)(H,21,24)(H,22,28)(H,25,26)(H,29,30)(H4,17,18,19)/t7-,8-,9-/m0/s1

InChI=1S/C40H68N14O16/c1-20(31(61)50-24(17-55)35(65)51-25(18-56)34(64)49-22(8-2-3-11-41)37(67)54-14-6-10-28(54)39(69)70)47-36(66)27-9-5-13-53(27)38(68)26(19-57)52-33(63)23(15-30(59)60)48-29(58)16-46-32(62)21(42)7-4-12-45-40(43)44/h20-28,55-57H,2-19,41-42H2,1H3,(H,46,62)(H,47,66)(H,48,58)(H,49,64)(H,50,61)(H,51,65)(H,52,63)(H,59,60)(H,69,70)(H4,43,44,45)/t20-,21-,22-,23-,24-,25-,26-,27-,28-/m0/s1

InChIKey=NNRFRJQMBSBXGO-CIUDSAMLSA-N



Database reference:
ACToR: ID 91037-65-9

BindingDB: ID 50241180

ChEMBL: ID CHEMBL265628

ChemIDplus: ID 91037-65-9

ChemSpider: ID 96932

DRugPortal: ID AC6UDA2MFC

FDA SRS: ID AC6UDA2MFC

J-GLOBAL: ID 200907021924818309

LINCS: ID LSM-45270

Nikkaji: ID J394.099C

PepBank: peptide RGDS

PubChem: CID 107775

SureChEMBL: ID SCHEMBL7394659

ZINC: ID ZINC000003927570