Name: Mdl 28564
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT214319897
Cas No:127370-75-6
常用名:Mdl 28564
别名:Mdl-28564, Mdl28564, Mdl-28,564, Mdl28,564, Mdl 28,564
别名:Mdl-28564, Mdl28564, Mdl-28,564, Mdl28,564, Mdl 28,564
IUPAC:(3S)-3-amino-3-{[(1S)-1-{[(1S)-1-{[(1S)-1-[({[(2S)-1-{[(1S)-1-carbamoyl-3-methylbutyl]amino}-4-methylpentan-2-yl]carbamoyl}methyl)carbamoyl]-2-methylpropyl]carbamoyl}-2-phenylethyl]carbamoyl}-2-hydroxyethyl]carbamoyl}propanoic acid
IUPAC:(3S)-3-amino-3-{[(1S)-1-{[(1S)-1-{[(1S)-1-[({[(2S)-1-{[(1S)-1-carbamoyl-3-methylbutyl]amino}-4-methylpentan-2-yl]carbamoyl}methyl)carbamoyl]-2-methylpropyl]carbamoyl}-2-phenylethyl]carbamoyl}-2-hydroxyethyl]carbamoyl}propanoic acid
InChI key:PWZNYVOVYOCFLQ-CJQGIMJOSA-N

分子式:C35H58N8O9
分子量:734.896
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CC(C)C[C@@H](CN[C@@H](CC(C)C)C(N)=O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(O)=O)C(C)C
SMILES:CC(C)C[C@@H](CN[C@@H](CC(C)C)C(N)=O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(O)=O)C(C)C

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