27856-54-8
中文名称
野芝麻新苷
英文名称
Lamiide
CAS
27856-54-8
分子式
C17H26O12
分子量
422.38
MOL 文件
27856-54-8.mol
更新日期
2025/10/17 11:59:06
27856-54-8 结构式
基本信息
中文别名
野芝麻新苷 英文别名
LamiideLamiide >=95% (LC/MS-ELSD)
(1S)-1,4a,5,6,7,7aα-Hexahydro-1-(β-D-glucopyranosyloxy)-4aα,6α,7α-trihydroxy-7-methylcyclopenta[c]pyran-4-carboxylic acid methyl ester
(1S)-1α-(β-D-Glucopyranosyloxy)-1,4a,5,6,7,7aα-hexahydro-4aα,6α,7α-trihydroxy-7-methylcyclopenta[c]pyran-4-carboxylic acid methyl ester
Cyclopenta[c]pyran-4-carboxylic acid, 1-(β-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-4a,6,7-trihydroxy-7-methyl-, methyl ester, (1S,4aR,6S,7R,7aS)-
(1S,4aR,6S,7R,7aS)-methyl 4a,6,7-trihydroxy-7-methyl-1-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate
所属类别
天然产物：环烯醚萜衍生物物理化学性质
沸点667.2±55.0 °C(Predicted)
密度1.66±0.1 g/cm3(Predicted)
储存条件-20°C
酸度系数(pKa)11.58±0.70(Predicted)
形态Solid
颜色White to off-white
主要应用metabolomics
vitamins, nutraceuticals, and natural products
vitamins, nutraceuticals, and natural products
InChIKeyVFYACENSDOLJGQ-SNONCDODSA-N
SMILESCOC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]3[C@@](C)(O)[C@@H](O)C[C@]13O