Amburoside A
HIT212524894
sdf文件结构编辑类似物检索
HIT ID: HIT212524894
Cas No: 110978-35-3
分子式: C20H22O10
分子量: 422.386
常用名: Amburoside A
氢键受体数 (HBA): 9
氢键供体数 (HBD): 6
LogP: 0.522
IUPAC: (4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl 3,4-dihydroxybenzoate
IUPAC: (4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl 3,4-dihydroxybenzoate
SMILES: OC[C@H]1O[C@@H](Oc2ccc(COC(=O)c3ccc(O)c(O)c3)cc2)[C@H](O)[C@@H](O)[C@@H]1O
SMILES: OC[C@H]1O[C@@H](Oc2ccc(COC(=O)c3ccc(O)c(O)c3)cc2)[C@H](O)[C@@H](O)[C@@H]1O
InChI key: LRFIKYDSTHZRKW-BFMVXSJESA-N
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