Praeroside II
HIT105245024
sdf文件结构编辑类似物检索
HIT ID: HIT105245024
Cas No: 84458-87-7;86940-46-7
分子式: C20H24O10
分子量: 424.402
常用名: Praeroside II
氢键受体数 (HBA): 9
氢键供体数 (HBD): 5
LogP: -0.957
IUPAC: (9R,10R)-10-hydroxy-8,8-dimethyl-9-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H,8H,9H,10H-pyrano[2,3-h]chromen-2-one
IUPAC: (9R,10R)-10-hydroxy-8,8-dimethyl-9-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H,8H,9H,10H-pyrano[2,3-h]chromen-2-one
SMILES: CC1(C)Oc2ccc3ccc(=O)oc3c2[C@@H](O)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
SMILES: CC1(C)Oc2ccc3ccc(=O)oc3c2[C@@H](O)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChI key: QAUDHOGPLBDVAX-GZFODPQLSA-N
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