Chemical Component Summary

NameStapled peptide
FormulaC80 H104 N27 O17
Molecular Weight1,715.852
TypePEPTIDE-LIKE
Isomeric SMILESCC(C)C[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NC(Cn2cc(nn2)-c3cc(cc(c3)C(=O)O)-c4cn(nn4)CC(C(=O)N[C@H](C(=O)N1)CCCNC(=[NH2+])N)NC(=O)CNC(=O)C)C(=O)NCC(=O)NCC(=O)N)Cc5c[nH]c[nH+]5)Cc6c[nH]c7c6cccc7)CCCC[NH3+])Cc8ccccc8)Cc9ccc(cc9)O
InChIn/a
InChIKeyn/a
CompositionPolymer Sequences: ACE-GLY-GLY-ARG-LEU-TYR-GLY-PHE-LYS-TRP-HIS-GLY-GLY-GLY-NH2
BIRD classINHIBITOR
Represented AsPOLYMER
Compound Detailsn/a
Descriptionn/a

Chemical Details

Formal Charge0
Atom Count228
Chiral Atom Count7
Bond Count236
Aromatic Bond Count43