(2S)-N-[(1S)-1-[[(1S)-1-[[2-[[(1S)-3-amino-1-[[(1S)-4-amino-1-[[(1S)-2-[[(1S)-2-[[(1S)-1-[[2-[[(1R)-1-benzyl-2-[[(1S)-1-[[(1S)-1-carbamoyl-3-methylsulfanyl-propyl]carbamoyl]-3-methyl-butyl]amino]-2-oxo-ethyl]amino]-2-oxo-ethyl]carbamoyl]-2-methyl-propyl]amino]-1-methyl-2-oxo-ethyl]amino]-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]carbamoyl]-4-oxo-butyl]carbamoyl]-3-oxo-propyl]amino]-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]carbamoyl]-4-guanidino-butyl]-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]pentanediamide

化合物标识与属性

CAS

108437-87-2

PubChem CID

101690278

SMILES

C[C@@H](C(=N[C@@H](C(C)C)C(=NCC(=N[C@H](CC1=CC=CC=C1)C(=N[C@@H](CC(C)C)C(=N[C@@H](CCSC)C(=N)O)O)O)O)O)O)N=C([C@H](CC2=CNC3=CC=CC=C32)N=C([C@H](CCC(=N)O)N=C([C@H](CC(=N)O)N=C(CN=C([C@H](CC(C)C)N=C([C@H](CCCNC(=N)N)N=C([C@H](CCC(=N)O)N=C([C@@H]4CCC(=N4)O)O)O)O)O)O)O)O)O

Canonical SMILES

CSCC[C@H](N=C(O)[C@H](CC(C)C)N=C(O)[C@@H](Cc1ccccc1)N=C(O)CN=C(O)[C@@H](N=C(O)[C@H](C)N=C(O)[C@H](Cc1c[nH]c2ccccc12)N=C(O)[C@H](CCC(=N)O)N=C(O)[C@H](CC(=N)O)N=C(O)CN=C(O)[C@H](CC(C)C)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCC(=N)O)N=C(O)[C@@H]1CCC(O)=N1)C(C)C)C(=N)O