Chemical Compound
(2-{[(2-{[(1R,3aS,3bR,5aR,7R,9aS,9bS,11aR)-1-[(2R)-4-({6-[(4R)-4-[(1R,3aS,3bR,5aR,7R,9aS,9bS,11aR)-7-[(2-amino-3-sulfanylpropanoyl)oxy]-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl]-N-methylpentanamido]hexa-2,4-diyn-1-yl}(methyl)carbamoyl)butan-2-yl]-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-7-yl]oxy}-2-oxoethyl)amino]methyl}phenyl)boronic acid
Primary record
(2-{[(2-{[(1R,3aS,3bR,5aR,7R,9aS,9bS,11aR)-1-[(2R)-4-({6-[(4R)-4-[(1R,3aS,3bR,5aR,7R,9aS,9bS,11aR)-7-[(2-amino-3-sulfanylpropanoyl)oxy]-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl]-N-methylpentanamido]hexa-2,4-diyn-1-yl}(methyl)carbamoyl)butan-2-yl]-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-7-yl]oxy}-2-oxoethyl)amino]methyl}phenyl)boronic acid
- 库存
- 550 克
- 纯度
- 98.1 %
化合物标识与属性
- PubChem CID
- 102409605
- SMILES
- B(C1=CC=CC=C1CNCC(=O)O[C@@H]2CC[C@]3([C@@H](C2)CC[C@@H]4[C@@H]3CC[C@]5([C@H]4CC[C@@H]5[C@H](C)CCC(=O)N(C)CC#CC#CCN(C)C(=O)CC[C@@H](C)[C@H]6CC[C@@H]7[C@@]6(CC[C@H]8[C@H]7CC[C@H]9[C@@]8(CC[C@H](C9)OC(=O)C(CS)N)C)C)C)C)(O)O
- Canonical SMILES
- C[C@H](CCC(=O)N(C)CC#CC#CCN(C)C(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)C(N)CS)CC[C@]4(C)[C@H]3CC[C@]12C)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)CNCc5ccccc5B(O)O)CC[C@]4(C)[C@H]3CC[C@]12C
名称与同义词
- J2.616.241F
- (2-{[(2-{[(1R,3aS,3bR,5aR,7R,9aS,9bS,11aR)-1-[(2R)-4-({6-[(4R)-4-[(1R,3aS,3bR,5aR,7R,9aS,9bS,11aR)-7-[(2-amino-3-sulfanylpropanoyl)oxy]-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl]-N-methylpentanamido]hexa-2,4-diyn-1-yl}(methyl)carbamoyl)butan-2-yl]-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-7-yl]oxy}-2-oxoethyl)amino]methyl}phenyl)boronic acid
- 1-[[3alpha-(2-Amino-3-mercaptopropanoyloxy)-24-oxo-5beta-cholane-24-yl](methyl)amino]-6-[[3alpha-[2-(dihydroxyboryl)benzylaminoacetoxy]-24-oxo-5beta-cholane-24-yl](methyl)amino]-2,4-hexadiyne