Name: Maximiscin
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT218964184
Cas No:1612154-44-5
常用名:Maximiscin
IUPAC:methyl (3R,4R,5R,6R)-6-({3-[(1R,2S,4R,6S)-2-ethenyl-4,6-dimethylcyclohexyl]-4-hydroxy-2-oxo-1,2-dihydropyridin-1-yl}oxy)-3,4,5-trihydroxycyclohex-1-ene-1-carboxylate
IUPAC:methyl (3R,4R,5R,6R)-6-({3-[(1R,2S,4R,6S)-2-ethenyl-4,6-dimethylcyclohexyl]-4-hydroxy-2-oxo-1,2-dihydropyridin-1-yl}oxy)-3,4,5-trihydroxycyclohex-1-ene-1-carboxylate
InChI key:BHUFOFQGYXAGAC-QMUCRNDTSA-N

分子式:C23H31NO8
分子量:449.5
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:COC(=O)C1=C[C@@H](O)[C@@H](O)[C@@H](O)[C@@H]1On1ccc(O)c([C@@H]2[C@@H](C)C[C@@H](C)C[C@H]2C=C)c1=O
SMILES:COC(=O)C1=C[C@@H](O)[C@@H](O)[C@@H](O)[C@@H]1On1ccc(O)c([C@@H]2[C@@H](C)C[C@@H](C)C[C@H]2C=C)c1=O

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