CAS: 426821-85-4; ((2R,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-(4-Hydroxy-3-Methoxyphenoxy)Tetrahydro-2H-Pyran-2-yl)Methyl 4-Hydroxy-3,5-Dimethoxybenzoate

• 英文名称((2R,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-(4-Hydroxy-3-Methoxyphenoxy)Tetrahydro-2H-Pyran-2-yl)Methyl 4-Hydroxy-3,5-Dimethoxybenzoate
• 中文名称4-羟基-3-甲氧基苯基 O-β-D-(6’-O-丁香酰)吡喃葡萄糖苷
• IUPAC名称((2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxy-3-methoxyphenoxy)tetrahydro-2H-pyran-2-yl)methyl 4-hydroxy-3,5-dimethoxybenzoate
• 其它别名4-Hydroxy-3-Methoxyphenyl β-D-[6-O-(4-Hydroxy-3,5-Dimethoxybenzoyl)]Glucopyranoside; 4-Hydroxy-3-Methoxyphenyl O-Beta-D-(6'-O-Syringate)Glucopyraside; 4-Hydroxy-3-Methoxyphenyl O-Beta-D-(6'-O-Syringate)Glucopyranoside; 4-Hydroxy-3-Methoxyphenol 1-O-(6-O-Syringoyl)Glucoside; β-D-Glucopyranoside, 4-Hydroxy-3-Methoxyphenyl, 6-(4-Hydroxy-3,5-Dimethoxybenzoate); 4-Hydroxy-3-Methoxyphenyl6-O-(4-Hydroxy-3,5-Dimethoxybenzoyl)-β-D-Glucopyranoside
• CAS编号426821-85-4
• 分子式:C22H26O12分子量:482.44
• 产品CID: 1439314
• 产品分类天然产物 → 酚类天然产物

• 相似结构搜索
• InChIKey: IXDFDPOPSXBXHH-QKYBYQKWSA-N
• InChI=1S/C22H26O12/c1-29-13-8-11(4-5-12(13)23)33-22-20(27)19(26)18(25)16(34-22)9-32-21(28)10-6-14(30-2)17(24)15(7-10)31-3/h4-8,16,18-20,22-27H,9H2,1-3H3/t16-,18-,19+,20-,
• 计算化学: 氢键受体数12.0氢键供体数5.0可旋转键数9.0

物理性质

• 沸点729.8±60.0 °C at 760 mmHg
• 闪点250.8±26.4 °C
• 密度1.5±0.1 g/cm3
• PSA:173.6
• LogP:0.89
• 折射率1.617
• 蒸汽压0.0±2.5 mmHg at 25°C
• 外观形态粉末
• 储存条件2-8°C，干燥环境，密闭

MSDS等安全信息

• 危险描述H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
• 防范说明P264+P280+P305+P351+P338+P337+P313
• 危险品标志Xi
• 安全声明H303+H313+H333

合成工艺路线路线简述

海关参考信息

• 2905122000-异丙醇
  2905310000-1,2-乙二醇
  2905320000-1,2-丙二醇
  2905399001-1,3-丙二醇
• 💡 提示：海关信息按照顺序优先匹配，如需确认的海关信息，请参考相关资料。
• 详情请参考：📖 海关编码查询和海关进出口税则

其他信息查阅

• ➥ 象形图和危险代码
• ➥ 防范代码详解
• ➥ 危险代码说明
• ➥ Globally Harmonized System
• ➥ REACH监管