Name: Senktide acetate
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT219136556
Cas No:
常用名:Senktide acetate
别名:Senktide acetate(106128-89-6 free base)
IUPAC:(3S)-3-{[(1S)-1-{[(1S)-1-[({[(1S)-1-{[(1S)-1-carbamoyl-3-(methylsulfanyl)propyl]carbamoyl}-3-methylbutyl]carbamoyl}methyl)carbamoyl]-2-phenylethyl](methyl)carbamoyl}-2-phenylethyl]carbamoyl}-3-(3-carboxypropanamido)propanoic acid; acetic acid
IUPAC:(3S)-3-{[(1S)-1-{[(1S)-1-[({[(1S)-1-{[(1S)-1-carbamoyl-3-(methylsulfanyl)propyl]carbamoyl}-3-methylbutyl]carbamoyl}methyl)carbamoyl]-2-phenylethyl](methyl)carbamoyl}-2-phenylethyl]carbamoyl}-3-(3-carboxypropanamido)propanoic acid; acetic acid
InChI key:RQJNLJRMAMZYDZ-FIYBGCGXSA-N

分子式:C42H59N7O13S
分子量:902.03
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CC(O)=O.CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(=O)CCC(O)=O)C(N)=O
SMILES:CC(O)=O.CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(=O)CCC(O)=O)C(N)=O

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