(2S)-2-[(2S,3S)-2-[(2R)-2-{[(2S)-1-[(2S)-2-[(2S)-2-{[(2S)-1-[(2S)-6-AMINO-2-[(2S)-3-CARBAMOYL-2-[(2S)-4-CARBOXY-2-[(2S)-3-(4-HYDROXYPHENYL)-2-[(2S)-4-METHYL-2-{[(2S)-5-OXOPYRROLIDIN-2-YL]FORMAMIDO}PENTANAMIDO]PROPANAMIDO]BUTANAMIDO]PROPANAMIDO]HEXANOYL]PYRROLIDIN-2-YL]FORMAMIDO}-5-CARBAMIMIDAMIDOPENTANAMIDO]-5-CARBAMIMIDAMIDOPENTANOYL]PYRROLIDIN-2-YL]FORMAMIDO}-3-(1H-INDOL-3-YL)PROPANAMIDO]-3-METHYLPENTANAMIDO]-4-METHYLPENTANOIC ACID

化合物标识与属性

CAS

73634-68-1

PubChem CID

171360613

SMILES

CC[C@H](C)[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@@H](CC1=CNC2=CC=CC=C21)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]4CCCN4C(=O)[C@H](CCCCN)NC(=O)C(CC(=O)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC5=CC=C(C=C5)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]6CCC(=O)N6

Canonical SMILES

CC[C@H](C)[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)C(CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CC(C)C)C(=O)O