Somatostatin (sheep reduced), N-((1,1-dimethylethoxy)carbonyl)-3-(S-((acetylamino)methyl)-l-cysteine)-4-(N6-((2-(methylsulfonyl)ethoxy)carbonyl)-l-lysine)-9-(N6-((2-(methylsulfonyl)ethoxy)carbonyl)-l-lysine)-14-(S-((acetylamino)methyl)-l-cysteine)-, 2-(((4-(phenylazo)phenyl)methyl)sulfonyl)ethyl ester

化合物标识与属性

CAS

76408-92-9

PubChem CID

91808919

SMILES

C[C@H]([C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CSCNC(=O)C)C(=O)OCCS(=O)(=O)CC2=CC=C(C=C2)N=NC3=CC=CC=C3)NC(=O)[C@H](CCCCNC(=O)OCCS(=O)(=O)C)NC(=O)[C@H](CC4=CNC5=CC=CC=C54)NC(=O)[C@H](CC6=CC=CC=C6)NC(=O)[C@H](CC7=CC=CC=C7)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CCCCNC(=O)OCCS(=O)(=O)C)NC(=O)[C@H](CSCNC(=O)C)NC(=O)CNC(=O)[C@H](C)NC(=O)OC(C)(C)C)O

Canonical SMILES

CC(=O)NCSC[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CCCCNC(=O)OCCS(C)(=O)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)OCCS(C)(=O)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CSCNC(C)=O)C(=O)OCCS(=O)(=O)Cc1ccc(N=Nc2ccccc2)cc1)[C@@H](C)O)[C@@H](C)O