BIOPEP-UWM: Virtual Peptide Data
ID
Name
Sequence
IGSENSEKTTMPLW
Chemical Mass
Number of residues
Monoisotopic Mass
EC50
IC50
µM
Additional Information
BIOPEP-UWM Virtual database SMILES: N[C@@]([H])([C@]([H])(CC)C)C(=O)NCC(=O)N[C@@]([H])(CO)C(=O)N[C@@]([H])(CCC(=O)O)C(=O)N[C@@]([H])(CC(=O)N)C(=O)N[C@@]([H])(CO)C(=O)N[C@@]([H])(CCC(=O)O)C(=O)N[C@@]([H])(CCCCN)C(=O)N[C@@]([H])([C@]([H])(O)C)C(=O)N[C@@]([H])([C@]([H])(O)C)C(=O)N[C@@]([H])(CCSC)C(=O)N1[C@@]([H])(CCC1)C(=O)N[C@@]([H])(CC(C)C)C(=O)N[C@@H](CC1=C[NH]C2=CC=CC=C12)C(=O)O InChI=1S/C69H109N17O24S/c1-8-34(4)54(72)65(105)74-30-51(92)75-47(31-87)62(102)77-42(19-21-53(95)96)58(98)80-45(28-50(71)91)61(101)83-48(32-88)63(103)78-41(18-20-52(93)94)57(97)76-40(16-11-12-23-70)59(99)84-56(36(6)90)67(107)85-55(35(5)89)66(106)79-43(22-25-111-7)68(108)86-24-13-17-49(86)64(104)81-44(26-33(2)3)60(100)82-46(69(109)110)27-37-29-73-39-15-10-9-14-38(37)39/h9-10,14-15,29,33-36,40-49,54-56,73,87-90H,8,11-13,16-28,30-32,70,72H2,1-7H3,(H2,71,91)(H,74,105)(H,75,92)(H,76,97)(H,77,102)(H,78,103)(H,79,106)(H,80,98)(H,81,104)(H,82,100)(H,83,101)(H,84,99)(H,85,107)(H,93,94)(H,95,96)(H,109,110)/t34-,35+,36+,40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,54-,55-,56-/m0/s1 InChIKey=XTSSNODHNDYFPY-FZGDCZEYSA-N Bioactivity predicted by molecular docking Predicted inhibitor of pancreatic lipase (EC 3.4.23.1) (PDB ID: 1ETH) according to the BIOPEP-UWM Virtual database (ID 350)
activity
references
function information
database references
screen and print virtual peptide data
list of virtual peptides
Virtual peptides links
Virt 350