Name: Pentagalloylglucose
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

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HIT ID:HIT104817153
Cas No:14937-32-7
常用名:Pentagalloylglucose
别名:Penta-O-galloyl-β-D-glucose, 1,2,3,4,6-五没食子酰葡萄糖, 1,2,3,4,6-Penta-O-galloyl-beta-D-glucopyranose, 1,2,3,4,6-O-Pentagalloylglucose
别名:Penta-O-galloyl-β-D-glucose, 1,2,3,4,6-五没食子酰葡萄糖, 1,2,3,4,6-Penta-O-galloyl-beta-D-glucopyranose, 1,2,3,4,6-O-Pentagalloylglucose
IUPAC:(2R,3R,4S,5R,6S)-4,5,6-tris(3,4,5-trihydroxybenzoyloxy)-2-[(3,4,5-trihydroxybenzoyloxy)methyl]oxan-3-yl 3,4,5-trihydroxybenzoate
IUPAC:(2R,3R,4S,5R,6S)-4,5,6-tris(3,4,5-trihydroxybenzoyloxy)-2-[(3,4,5-trihydroxybenzoyloxy)methyl]oxan-3-yl 3,4,5-trihydroxybenzoate
InChI key:QJYNZEYHSMRWBK-NIKIMHBISA-N

分子式:C41H32O26
分子量:940.681
氢键供体数 (HBD):15
氢键受体数 (HBA):21
LogP:4.99
SMILES:Oc1cc(cc(O)c1O)C(=O)OC[C@H]1O[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@@H]1OC(=O)c1cc(O)c(O)c(O)c1
SMILES:Oc1cc(cc(O)c1O)C(=O)OC[C@H]1O[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@@H]1OC(=O)c1cc(O)c(O)c(O)c1

Pentagalloylglucose (Standard) 是 Pentagalloylglucose 的标准品。适用于定量分析、质量控制及生化实验等相关研究。1,2,3,4,6-O-Pentagalloylglucose (Penta-O-galloyl-β-D-glucose) 存在于多种植物中，具有重要的药理作用。Pentagalloylglucose 表现出显著的抗狂犬病病毒 (RABV) 活性。

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