(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-6-amino-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-amino-4-methylsulfanyl-butanoyl]amino]-4-methyl-pentanoyl]amino]-3-hydroxy-butanoyl]amino]hexanoyl]amino]-3-phenyl-propanoyl]amino]-4-carboxy-butanoyl]amino]-3-hydroxy-butanoyl]amino]hexanoyl]amino]-3-hydroxy-propanoyl]amino]propanoyl]amino]-5-guanidino-pentanoyl]amino]-3-methyl-butanoyl]amino]hexanoyl]amino]acetyl]amino]-4-methyl-pentanoyl]amino]-3-hydroxy-propanoyl]amino]-3-phenyl-propanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]pyrrolidine-2-carbonyl]amino]hexanoyl]amino]-5-guanidino-pentanoyl]pyrrolidine-2-carbonyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-methyl-pentanoyl]amino]-4-methyl-pentanoic acid

化合物标识与属性

CAS

144092-28-4

PubChem CID

56947118

SMILES

CC[C@H](C)[C@@H](C(=N[C@@H](CC(C)C)C(=O)O)O)N=C([C@H](CC1=CNC2=CC=CC=C21)N=C([C@@H]3CCCN3C(=O)[C@H](CCCNC(=N)N)N=C([C@H](CCCCN)N=C([C@@H]4CCCN4C(=O)[C@H](CC5=CN=CN5)N=C([C@H](CC6=CC=CC=C6)N=C([C@H](CO)N=C([C@H](CC(C)C)N=C(CN=C([C@H](CCCCN)N=C([C@H](C(C)C)N=C([C@H](CCCNC(=N)N)N=C([C@H](C)N=C([C@H](CO)N=C([C@H](CCCCN)N=C([C@H]([C@@H](C)O)N=C([C@H](CCC(=O)O)N=C([C@H](CC7=CC=CC=C7)N=C([C@H](CCCCN)N=C([C@H]([C@@H](C)O)N=C([C@H](CC(C)C)N=C([C@H](CCSC)N)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O

Canonical SMILES

CC[C@H](C)[C@H](N=C(O)[C@H](Cc1c[nH]c2ccccc12)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCCCN)N=C(O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@H](CO)N=C(O)[C@H](CC(C)C)N=C(O)CN=C(O)[C@H](CCCCN)N=C(O)[C@@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](C)N=C(O)[C@H](CO)N=C(O)[C@H](CCCCN)N=C(O)[C@@H](N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@H](CCCCN)N=C(O)[C@@H](N=C(O)[C@H](CC(C)C)N=C(O)[C@@H](N)CCSC)[C@@H](C)O)[C@@H](C)O)C(C)C)C(O)=N[C@@H](CC(C)C)C(=O)O