Name: Feretoside
Rating: 5 (10 reviews)

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结构编辑

类似物检索

HIT ID:HIT212664972
Cas No:27530-67-2
常用名:Feretoside
别名:鸡矢藤次苷甲酯
IUPAC:methyl (1S,4aS,5R,7aS)-5-hydroxy-7-(hydroxymethyl)-1-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,4aH,5H,7aH-cyclopenta[c]pyran-4-carboxylate
IUPAC:methyl (1S,4aS,5R,7aS)-5-hydroxy-7-(hydroxymethyl)-1-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,4aH,5H,7aH-cyclopenta[c]pyran-4-carboxylate
InChI key:WSGPLSDARZNMCW-LPGRTNKPSA-N

分子式:C17H24O11
分子量:404.368
氢键供体数 (HBD):6
氢键受体数 (HBA):10
LogP:-3.3675888
SMILES:COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1[C@H](O)C=C2CO |c:26,t:4|
SMILES:COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1[C@H](O)C=C2CO |c:26,t:4|

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