AChE/BChE-IN-11
HIT218850817
sdf文件结构编辑类似物检索
HIT ID: HIT218850817
Cas No: 80443-12-5
分子式: C21H22O12
分子量: 466.395
常用名: AChE/BChE-IN-11
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (2R,3R)-5,7-dihydroxy-3-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one
IUPAC: (2R,3R)-5,7-dihydroxy-3-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one
SMILES: C[C@@H]1O[C@@H](O[C@@H]2[C@H](Oc3cc(O)cc(O)c3C2=O)c2cc(O)c(O)c(O)c2)[C@H](O)[C@H](O)[C@H]1O
SMILES: C[C@@H]1O[C@@H](O[C@@H]2[C@H](Oc3cc(O)cc(O)c3C2=O)c2cc(O)c(O)c(O)c2)[C@H](O)[C@H](O)[C@H]1O
InChI key: QMGYCEQXKDMHDB-JFWXUUDPSA-N
共显示1个结果
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