CAS: 32685-93-1; Sipeimine-3β-D-Glucoside

• 英文名称Sipeimine-3β-D-Glucoside
• 中文名称西贝母碱苷
• IUPAC名称(3S,4aS,6aS,6bS,8aS,9S,9aS,12S,15aS,15bR,16aS,16bR)-9-hydroxy-9,12,16b-trimethyl-3-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)docosahydrobenzo[4,5]indeno[1,2-h]pyrido[1,2-b]isoquinolin-5(1H)-one
• 其它别名Edpetiline; Sipeimine-3Beta-D-Glucoside; Sipeimine-3Ss-D-Glucoside; F85B5Io5At; (1R,2S,6S,9S,10S,11S,14S,15S,18S,20S,23R,24S)-10-Hydroxy-6,10,23-Trimethyl-20-[(2R,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxy-4-Azahexacyclo[12.11.0.0
• CAS编号32685-93-1
• MFCD编号:MFCD29048508
• FDA UNII编号:F85B5IO5AT
• 分子式:C33H53NO8分子量:591.79
• 产品CID: 1318236
• 产品分类生物化工 → 提取物

• 相似结构搜索
• InChIKey: DHQFYEJMFMYGCV-RRIRULBESA-N
• InChI=1S/C33H53NO8/c1-16-4-7-27-33(3,40)22-6-5-18-19(21(22)14-34(27)13-16)11-23-20(18)12-25(36)24-10-17(8-9-32(23,24)2)41-31-30(39)29(38)28(37)26(15-35)42-31/h16-24,26-31
• 计算化学: 氢键受体数9.0氢键供体数5.0可旋转键数3.0

物理性质

• 熔点272-276 °C (methanol )
• 沸点742.7±60.0 °C at 760 mmHg
• 闪点403.0±32.9 °C
• 密度1.3±0.1 g/cm3
• pKa:12.90±0.70(预测)
• PSA:139.92
• LogP:1.85
• 折射率1.612
• 蒸汽压0.0±5.6 mmHg at 25°C
• 外观形态白色至类白色固体
• 储存条件2-8°C(避光保存)
• 产品应用该化合物是生化物

MSDS等安全信息

• 警示词warning
• 危险描述H303 May be harmful if swallowed+H313 Skin contact may be harmful+H333 Inhalation may be harmful to the body
• 防范说明P264Thoroughly clean after treatmentP280Wear protective gloves/Wear protective clothing/Wear protective goggles/Wear a protective maskP305If it enters the eyesP351Rinse carefully with water for a few minutesP338Remove the contact lens(If any)And easy to operate,Continue flushingP337If eye irritation persistsP313Obtain medical advice/care
• 安全声明H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body

合成工艺路线路线简述

海关参考信息

• 2905122000-异丙醇
  2905143000-叔丁醇
  2905310000-1,2-乙二醇
  2905320000-1,2-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