Chemical Compound
tert-butyl (3S)-3-{[(1S)-1-{[(1S,2S)-1-{[(1S)-1-{[(1S)-1-{[(1S)-1-[({[(1S)-1-({[(4-{[(2S)-2-aminopropanoyl]carbamoyl}phenyl)({2-[(triphenylmethyl)sulfanyl]ethyl})carbamoyl]methyl}carbamoyl)-3-methylbutyl]carbamoyl}methyl)carbamoyl]-2-(tert-butoxy)ethyl]carbamoyl}-2-(tert-butoxy)ethyl]carbamoyl}-2-(tert-butoxy)ethyl]carbamoyl}-2-methylbutyl]carbamoyl}-4-{N'-[(2,2,4,6,7-pentamethyl-2,3-dihydro-1-benzofuran-5-yl)sulfonyl]carbamimidamido}butyl]carbamoyl}-3-[(2S)-2-[(2S)-6-{[(tert-butoxy)carbonyl]amino}-2-[(2S)-2-[(2S)-2-[(2R)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-[(triphenylmethyl)sulfanyl]propanamido]-3-phenylpropanamido]-5-{N'-[(2,2,4,6,7-pentamethyl-2,3-dihydro-1-benzofuran-5-yl)sulfonyl]carbamimidamido}pentanamido]hexanamido]-4-(methylsulfanyl)butanamido]propanoate
Primary record
tert-butyl (3S)-3-{[(1S)-1-{[(1S,2S)-1-{[(1S)-1-{[(1S)-1-{[(1S)-1-[({[(1S)-1-({[(4-{[(2S)-2-aminopropanoyl]carbamoyl}phenyl)({2-[(triphenylmethyl)sulfanyl]ethyl})carbamoyl]methyl}carbamoyl)-3-methylbutyl]carbamoyl}methyl)carbamoyl]-2-(tert-butoxy)ethyl]carbamoyl}-2-(tert-butoxy)ethyl]carbamoyl}-2-(tert-butoxy)ethyl]carbamoyl}-2-methylbutyl]carbamoyl}-4-{N'-[(2,2,4,6,7-pentamethyl-2,3-dihydro-1-benzofuran-5-yl)sulfonyl]carbamimidamido}butyl]carbamoyl}-3-[(2S)-2-[(2S)-6-{[(tert-butoxy)carbonyl]amino}-2-[(2S)-2-[(2S)-2-[(2R)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-[(triphenylmethyl)sulfanyl]propanamido]-3-phenylpropanamido]-5-{N'-[(2,2,4,6,7-pentamethyl-2,3-dihydro-1-benzofuran-5-yl)sulfonyl]carbamimidamido}pentanamido]hexanamido]-4-(methylsulfanyl)butanamido]propanoate
- 库存
- 550 克
- 纯度
- 98.1 %
化合物标识与属性
- PubChem CID
- 177577687
- SMILES
- CC[C@H](C)[C@@H](C(=O)N[C@@H](COC(C)(C)C)C(=O)N[C@@H](COC(C)(C)C)C(=O)N[C@@H](COC(C)(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N(CCSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=C(C=C4)C(=O)NC(=O)[C@H](C)N)NC(=O)[C@H](CCCNC(=N)NS(=O)(=O)C5=C(C6=C(C(=C5C)C)OC(C6)(C)C)C)NC(=O)[C@H](CC(=O)OC(C)(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCNC(=O)OC(C)(C)C)NC(=O)[C@H](CCCNC(=N)NS(=O)(=O)C7=C(C8=C(C(=C7C)C)OC(C8)(C)C)C)NC(=O)[C@H](CC9=CC=CC=C9)NC(=O)[C@H](CSC(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12
- Canonical SMILES
- CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)NS(=O)(=O)c1c(C)c(C)c2c(c1C)CC(C)(C)O2)NC(=O)[C@H](CC(=O)OC(C)(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCNC(=O)OC(C)(C)C)NC(=O)[C@H](CCCNC(=N)NS(=O)(=O)c1c(C)c(C)c2c(c1C)CC(C)(C)O2)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CSC(c1ccccc1)(c1ccccc1)c1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N[C@@H](COC(C)(C)C)C(=O)N[C@@H](COC(C)(C)C)C(=O)N[C@@H](COC(C)(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N(CCSC(c1ccccc1)(c1ccccc1)c1ccccc1)c1ccc(C(=O)NC(=O)[C@H](C)N)cc1
名称与同义词
- J2.830.814K
- N-[4-[[Fmoc-S-Trityl-L-Cys-L-Phe-omega-(2,2,4,6,7-pentamethyl-2,3-dihydrobenzofuran-5-ylsulfonyl)-L-Arg-N6-Boc-L-Lys-L-Met-L-alphabetaAsp-(OBut)-omega-(2,2,4,6,7-pentamethyl-2,3-dihydrobenzofuran-5-ylsulfonyl)-L-Arg-L-Ile-O-tert-butyl-L-Ser-O-tert-butyl-L-Ser-O-tert-butyl-L-Ser-Gly-L-Leu-Gly-][2-(tritylthio)ethyl]amino]benzoyl]-L-alaninamide
- tert-butyl (3S)-3-{[(1S)-1-{[(1S,2S)-1-{[(1S)-1-{[(1S)-1-{[(1S)-1-[({[(1S)-1-({[(4-{[(2S)-2-aminopropanoyl]carbamoyl}phenyl)({2-[(triphenylmethyl)sulfanyl]ethyl})carbamoyl]methyl}carbamoyl)-3-methylbutyl]carbamoyl}methyl)carbamoyl]-2-(tert-butoxy)ethyl]carbamoyl}-2-(tert-butoxy)ethyl]carbamoyl}-2-(tert-butoxy)ethyl]carbamoyl}-2-methylbutyl]carbamoyl}-4-{N'-[(2,2,4,6,7-pentamethyl-2,3-dihydro-1-benzofuran-5-yl)sulfonyl]carbamimidamido}butyl]carbamoyl}-3-[(2S)-2-[(2S)-6-{[(tert-butoxy)carbonyl]amino}-2-[(2S)-2-[(2S)-2-[(2R)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-[(triphenylmethyl)sulfanyl]propanamido]-3-phenylpropanamido]-5-{N'-[(2,2,4,6,7-pentamethyl-2,3-dihydro-1-benzofuran-5-yl)sulfonyl]carbamimidamido}pentanamido]hexanamido]-4-(methylsulfanyl)butanamido]propanoate