CAS: 109194-60-7; (2S,3R,4S,5S,6R)-2-(4-Hydroxy-3-Methoxyphenoxy)-6-(Hydroxymethyl)Tetrahydro-2H-Pyran-3,4,5-Triol

英文名称(2S,3R,4S,5S,6R)-2-(4-Hydroxy-3-Methoxyphenoxy)-6-(Hydroxymethyl)Tetrahydro-2H-Pyran-3,4,5-Triol
中文名称它乔糖甙
IUPAC名称(2S,3R,4S,5S,6R)-2-(4-hydroxy-3-methoxyphenoxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol
其它别名1-O-(3-Methoxy-4-Hydroxyphenyl)-β-D-Glucopyranose; 1-O-(4-Hydroxy-3-Methoxyphenyl)-β-D-Glucopyranose; 2-Methoxy-4-(β-D-Glucopyranosyloxy)Phenol; 4-Hydroxy-3-Methoxyphenyl β-D-Glucopyranoside; Tachioside; Terrestrinin R; β-D-Glucopyranoside, 4-Hydroxy-3-Methoxyphenyl; 4-Hydroxy-3-Methoxyphenylβ-D-Glucopyranoside
CAS编号109194-60-7
MFCD编号:MFCD20260944
分子式:C13H18O8分子量:302.28
产品CID: 126888
产品分类天然产物 → 酚类

相似结构搜索
产品信息参考;
InChIKey: KWVHACHAQJFTLZ-UJPOAAIJSA-N
InChI=1S/C13H18O8/c1-19-8-4-6(2-3-7(8)15)20-13-12(18)11(17)10(16)9(5-14)21-13/h2-4,9-18H,5H2,1H3/t9-,10-,11+,12-,13-/m1/s1
计算化学: 氢键受体数8.0氢键供体数5.0可旋转键数4.0

物理性质

沸点577.4±50.0 °C(预测)
闪点303.0±30.1 °C
密度1.519±0.06 g/cm3(预测)
pKa:10.14±0.20(预测)
PSA:128.84
LogP:-1.4205
溶解性Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
外观形态粉末

上下游产品

methanol -β-D-glucopyranoside2-Methoxyhydroquinone 4-O-6-O-(4-O-α-L-rhamnopyranosyl)-syringyl-β-D-glucopyranoside methoxyhydroquinone 2,3,4,6-tetra-O-acetyl-α-D-glucopyranosyl bromide 3,4-dimethoxybenzyl alcohol O-β-D-glucopyranoside methoxyhydroquinone

合成工艺路线路线简述

📜4-Hydroxy-3-Methoxyphenol 1-O-β-D-(6'-O-Galloyl)-Glucopyranoside置于水体系中,化学反应 3.0H,反应生成它乔糖甙
参考文献:Phenolic Glucoside Gallates From Quercus Mongolica And Q. Acutissima
标题:Phenolic Glucoside Gallates From Quercus Mongolica And Q. Acutissima
摘要:
Doi:10.1016/s0031-9422(00)82367-5