Name: 8-Epiloganic acid
Rating: 5 (10 reviews)

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结构编辑

类似物检索

HIT ID:HIT212666028
Cas No:82509-41-9
常用名:8-Epiloganic acid
别名:8-表马钱子苷酸, 8-Epi-Loganic acid
IUPAC:(1S,4aS,6S,7S,7aS)-6-hydroxy-7-methyl-1-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyran-4-carboxylic acid
IUPAC:(1S,4aS,6S,7S,7aS)-6-hydroxy-7-methyl-1-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyran-4-carboxylic acid
InChI key:JNNGEAWILNVFFD-OZFVSFPVSA-N

分子式:C16H24O10
分子量:376.358
氢键供体数 (HBD):6
氢键受体数 (HBA):10
LogP:-2.216373
SMILES:C[C@@H]1[C@@H](O)C[C@H]2[C@@H]1[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC=C2C(O)=O |c:23|
SMILES:C[C@@H]1[C@@H](O)C[C@H]2[C@@H]1[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC=C2C(O)=O |c:23|

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