CAS: 165338-27-2; (2R,3R,4R,5R,6R)-5-Hydroxy-6-(3-Hydroxy-4-Methoxyphenethoxy)-2-(Hydroxymethyl)-4-(((2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydro-2H-Pyran-2-yl)Oxy)Tetrahydro-2H-Pyran-3-Yl (E)-3-(4-Hydroxy-3-Methoxyphenyl)Acrylate

• 英文名称(2R,3R,4R,5R,6R)-5-Hydroxy-6-(3-Hydroxy-4-Methoxyphenethoxy)-2-(Hydroxymethyl)-4-(((2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydro-2H-Pyran-2-yl)Oxy)Tetrahydro-2H-Pyran-3-Yl (E)-3-(4-Hydroxy-3-Methoxyphenyl)Acrylate
• 中文名称鞭打绣球甙 A
• IUPAC名称(2R,3R,4R,5R,6R)-5-hydroxy-6-(3-hydroxy-4-methoxyphenethoxy)-2-(hydroxymethyl)-4-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-3-yl (E)-3-(4-hydroxy-3-methoxyphenyl)acrylate
• 其它别名Hemiphroside A; B-D-Glucopyranoside,2-(3-Hydroxy-4-Methoxyphenyl)Ethyl 3-O-B-D-Glucopyranosyl-,4-[(2E)-3-(4-Hydroxy-3-Methoxyphenyl)-2-Propenoate] (9Ci); β-D-Glucopyranoside, 2-(3-Hydroxy-4-Methoxyphenyl)Ethyl 3-O-β-D-Glucopyranosyl-, 4-[(2E)-3-(4-Hydroxy-3-Methoxyphenyl)-2-Propenoate]
• CAS编号165338-27-2
• MFCD编号:MFCD20260685
• 分子式:C31H40O16分子量:668.65
• 产品CID: 839356
• 产品分类天然产物 → 酚类天然产物

• 相似结构搜索
• InChIKey: VKUXVDUAEAQCSK-MJLPRLLOSA-N
• InChI=1S/C31H40O16/c1-41-19-7-4-16(11-18(19)35)9-10-43-30-27(40)29(47-31-26(39)25(38)24(37)21(13-32)44-31)28(22(14-33)45-30)46-23(36)8-5-15-3-6-17(34)20(12-15)42-2/h3-8,1
• 计算化学: 氢键受体数16.0氢键供体数8.0可旋转键数14.0

物理性质

• 沸点905.4±65.0 °C at 760 mmHg
• 闪点287.6±27.8 °C
• 密度1.5±0.1 g/cm3
• pKa:8.61±0.20(预测)
• PSA:243.52
• LogP:-0.24
• 折射率1.654
• 蒸汽压0.0±0.3 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

• 2901210000-乙烯
  2901220000-丙烯
  2902500000-苯乙烯
  2902600000-乙苯
• 💡 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