CAS: 509-18-2; 1-Ethyl-8,10,13-Trimethoxy-3-(Methoxymethyl)Dodecahydro-2H-3,6A,12-(Epiethane[1,1,2]Triyl)-7,9-Methanonaphtho[2,3-B]Azocine-6,11A,12-Triol

• 英文名称1-Ethyl-8,10,13-Trimethoxy-3-(Methoxymethyl)Dodecahydro-2H-3,6A,12-(Epiethane[1,1,2]Triyl)-7,9-Methanonaphtho[2,3-B]Azocine-6,11A,12-Triol
• 中文名称硬飞燕草碱
• IUPAC名称1-ethyl-8,10,13-trimethoxy-3-(methoxymethyl)dodecahydro-2H-3,6a,12-(epiethane[1,1,2]triyl)-7,9-methanonaphtho[2,3-b]azocine-6,11a,12-triol
• 其它别名20-Ethyl-6β,14α,16β-Trimethoxy-4-(Methoxymethyl)Aconitane-1α,7,8-Triol; Delsoline, Consoline; 14-O-Methyldelcosine; 18-O-Methylgigactonine; Belsoline; (1α,6β,8ξ,14α,16β,17R)-20-Ethyl-6,14,16-Trimethoxy-4-(Methoxymeth Yl)Aconitane-1,7,8-Triol; Aconitane-1,7,8-Triol, 20-Ethyl-6,14,16-Trimethoxy-4-(Methoxymethyl)-, (1α,6β,14α,16β)-; (1α,6β,8ξ,14α,16β,17R)-20-Ethyl-6,14,16-Trimethoxy-4-(Methoxymethyl)Aconitane-1,7,8-Triol
• CAS编号509-18-2
• MFCD编号:MFCD00274545
• FDA UNII编号:8NCS5NCP4W
• 分子式:C25H41NO7分子量:467.6
• 产品CID: 1497976
• 产品分类生物化工 → 提取物

• 相似结构搜索
• 产品信息参考;;;;
• InChIKey: JVBLTQQBEQQLEV-RHDHAXOPSA-N
• InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3
• 计算化学: 氢键受体数8.0氢键供体数3.0可旋转键数6.0

物理性质

• 熔点214 °C
• 沸点576.0±50.0 °C at 760 mmHg
• 闪点302.1±30.1 °C
• 密度1.3±0.1 g/cm3
• PH:D22 +53.4° (c = 2.04 in chloroform)
• pKa:12.36±0.70(预测)
• PSA:100.85
• LogP:-0.27
• 折射率1.596
• 蒸汽压0.0±3.6 mmHg at 25°C
• 溶解性Soluble In Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,Etc.
• 外观形态白色粉末
• 储存条件2-8°C
• 产品应用该化合物用作缓解肌肉紧张或高血压,因为其具有类似阴道和帮派阻塞作用.

MSDS等安全信息

• 警示词Warning
• 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

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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
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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