(4S)-4-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-6-AMINO-2-[(2S)-2-[(2S)-2-[(2S)-6-AMINO-2-[(2S)-6-AMINO-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-6-AMINO-2-{2-[(2S,3S)-2-(2-AMINOACETAMIDO)-3-METHYLPENTANAMIDO]ACETAMIDO}HEXANAMIDO]-3-PHENYLPROPANAMIDO]-4-METHYLPENTANAMIDO]-3-(1H-IMIDAZOL-4-YL)PROPANAMIDO]PROPANAMIDO]PROPANAMIDO]HEXANAMIDO]HEXANAMIDO]-3-PHENYLPROPANAMIDO]PROPANAMIDO]HEXANAMIDO]PROPANAMIDO]-3-PHENYLPROPANAMIDO]-3-METHYLBUTANAMIDO]PROPANAMIDO]-4-{[(1S,2S)-1-{[(1S)-1-{[(1S)-2-CARBAMOYL-1-{[(1S)-1-CARBAMOYL-2-HYDROXYETHYL]CARBAMOYL}ETHYL]CARBAMOYL}-3-(METHYLSULFANYL)PROPYL]CARBAMOYL}-2-METHYLBUTYL]CARBAMOYL}BUTANOIC ACID

化合物标识与属性

CAS

117665-48-2

PubChem CID

24755324

SMILES

CC[C@H](C)[C@@H](C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC2=CNC=N2)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC4=CC=CC=C4)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CO)C(=O)N)NC(=O)CN

Canonical SMILES

CC[C@H](C)[C@H](NC(=O)CN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(N)=O)[C@@H](C)CC)C(C)C