(2S)-N-[(1S)-4-carbamimidamido-1-{[(1S)-1-carbamoyl-2-{3-[(2,6-dichlorophenyl)methyl]-4-hydroxyphenyl}ethyl]carbamoyl}butyl]-2-[(2S)-5-carbamimidamido-2-[(2R,3S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-3-carbamoyl-2-[(2S,3S)-2-[(2S)-3-{3-[(2,6-dichlorophenyl)methyl]-4-hydroxyphenyl}-2-acetamidopropanamido]-3-methylpentanamido]propanamido]-4-methylpentanamido]-3-methylpentanamido]-3-hydroxybutanamido]pentanamido]pentanediamide

化合物标识与属性

CAS

146999-93-1

PubChem CID

168012476

SMILES

CC[C@H](C)[C@@H](C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@H]([C@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC1=CC(=C(C=C1)O)CC2=C(C=CC=C2Cl)Cl)C(=O)N)NC(=O)[C@H](CC3=CC(=C(C=C3)O)CC4=C(C=CC=C4Cl)Cl)NC(=O)C

Canonical SMILES

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)c(Cc2c(Cl)cccc2Cl)c1)NC(C)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)c(Cc2c(Cl)cccc2Cl)c1)C(N)=O)[C@H](C)O)[C@@H](C)CC