tert-butyl (4S)-4-{[(1S)-3-(tert-butoxy)-1-carbamoyl-3-oxopropyl]carbamoyl}-4-[(2S)-6-{[(tert-butoxy)carbonyl]amino}-2-[(2S)-2-[(2S)-6-{[(tert-butoxy)carbonyl]amino}-2-[(2S)-6-{[(tert-butoxy)carbonyl]amino}-2-[(2S)-6-{[(tert-butoxy)carbonyl]amino}-2-{[(2S)-1-[(2S)-2-(2-oxoacetamido)propanoyl]pyrrolidin-2-yl]formamido}hexanamido]hexanamido]hexanamido]-5-{N'-[(2,2,5,7,8-pentamethyl-3,4-dihydro-2H-1-benzopyran-6-yl)sulfonyl]carbamimidamido}pentanamido]hexanamido]butanoate

化合物标识与属性

PubChem CID

102378252

SMILES

CC1=C(C(=C(C2=C1OC(CC2)(C)C)C)S(=O)(=O)NC(=NCCC[C@@H](C(=O)N[C@@H](CCCCNC(=O)OC(C)(C)C)C(=O)N[C@@H](CCC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)OC(C)(C)C)C(=O)N)NC(=O)[C@H](CCCCNC(=O)OC(C)(C)C)NC(=O)[C@H](CCCCNC(=O)OC(C)(C)C)NC(=O)[C@H](CCCCNC(=O)OC(C)(C)C)NC(=O)[C@@H]3CCCN3C(=O)[C@H](C)NC(=O)C=O)N)C

Canonical SMILES

Cc1c(C)c(S(=O)(=O)NC(N)=NCCC[C@H](NC(=O)[C@H](CCCCNC(=O)OC(C)(C)C)NC(=O)[C@H](CCCCNC(=O)OC(C)(C)C)NC(=O)[C@H](CCCCNC(=O)OC(C)(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](C)NC(=O)C=O)C(=O)N[C@@H](CCCCNC(=O)OC(C)(C)C)C(=O)N[C@@H](CCC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)OC(C)(C)C)C(N)=O)c(C)c2c1OC(C)(C)CC2