Name: Ferensimycin B
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT219600077
Cas No:135501-80-3
常用名:Ferensimycin B
IUPAC:(2S)-2-[(2R,3R,5S,6S)-6-[(2S,3S,4S,6R)-6-[(2S,2'R,3'R,4S,5S,5'R)-5'-ethyl-2'-hydroxy-5'-[(1S)-1-hydroxypropyl]-2,3',4-trimethyl-[2,2'-bioxolan]-5-yl]-3-hydroxy-4-methyl-5-oxooctan-2-yl]-2-hydroxy-3,5-dimethyloxan-2-yl]propanoic acid sodium
IUPAC:(2S)-2-[(2R,3R,5S,6S)-6-[(2S,3S,4S,6R)-6-[(2S,2'R,3'R,4S,5S,5'R)-5'-ethyl-2'-hydroxy-5'-[(1S)-1-hydroxypropyl]-2,3',4-trimethyl-[2,2'-bioxolan]-5-yl]-3-hydroxy-4-methyl-5-oxooctan-2-yl]-2-hydroxy-3,5-dimethyloxan-2-yl]propanoic acid sodium
InChI key:MQHYIXQYYOOZAJ-UMMVOMBSSA-N

分子式:C35H62NaO10
分子量:665.861
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[Na].[H][C@@]1(O[C@@](C)(C[C@@H]1C)[C@]1(O)O[C@](CC)(C[C@H]1C)[C@@H](O)CC)[C@@H](CC)C(=O)[C@@H](C)[C@@H](O)[C@H](C)[C@@]1([H])O[C@@](O)([C@H](C)C(O)=O)[C@H](C)C[C@@H]1C
SMILES:[Na].[H][C@@]1(O[C@@](C)(C[C@@H]1C)[C@]1(O)O[C@](CC)(C[C@H]1C)[C@@H](O)CC)[C@@H](CC)C(=O)[C@@H](C)[C@@H](O)[C@H](C)[C@@]1([H])O[C@@](O)([C@H](C)C(O)=O)[C@H](C)C[C@@H]1C

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