50981-09-4
中文名称
VERONICOSIDE
英文名称
[(1aS)-6α-Benzoyloxy-1a,1bα,2,5aα,6,6aβ-hexahydro-1a-hydroxymethyloxireno[4,5]cyclopenta[1,2-c]pyran-2α-yl]β-D-glucopyranoside
CAS
50981-09-4
分子式
C22H26O11
分子量
466.44
MOL 文件
50981-09-4.mol
结构式
基本信息
中文别名
英文别名
Veronicoside
Veronicoside >=95% (LC/MS-ELSD)
[(1aS)-6α-Benzoyloxy-1a,1bα,2,5aα,6,6aβ-hexahydro-1a-hydroxymethyloxireno[4,5]cyclopenta[1,2-c]pyran-2α-yl]β-D-glucopyranoside
β-D-Glucopyranoside, (1aS,1bS,2S,5aR,6S,6aS)-6-(benzoyloxy)-1a,1b,2,5a,6,6a-hexahydro-1a-(hydroxymethyl)oxireno[4,5]cyclopenta[1,2-c]pyran-2-yl
Veronicoside >=95% (LC/MS-ELSD)
[(1aS)-6α-Benzoyloxy-1a,1bα,2,5aα,6,6aβ-hexahydro-1a-hydroxymethyloxireno[4,5]cyclopenta[1,2-c]pyran-2α-yl]β-D-glucopyranoside
β-D-Glucopyranoside, (1aS,1bS,2S,5aR,6S,6aS)-6-(benzoyloxy)-1a,1b,2,5a,6,6a-hexahydro-1a-(hydroxymethyl)oxireno[4,5]cyclopenta[1,2-c]pyran-2-yl
物理化学性质
| 沸点 | 710.0±60.0 °C(Predicted) |
| 密度 | 1.60±0.1 g/cm3(Predicted) |
| 储存条件 | -20°C |
| 酸度系数(pKa) | 12.79±0.70(Predicted) |
| 形态 | solid |
| 主要应用 | metabolomics vitamins, nutraceuticals, and natural products |
| InChIKey | GOHHRVCULPSXEU-RWORTQBESA-N |
| SMILES | OC[C@H]1O[C@@H](O[C@@H]2OC=C[C@H]3[C@H](OC(=O)c4ccccc4)[C@@H]5O[C@]5(CO)[C@@H]23)[C@H](O)[C@@H](O)[C@@H]1O |
安全数据
| WGK Germany | 3 |
| 存储类别 | 11 - Combustible Solids |