CAS: 189322-67-6; (1R,2R,3S,3Ar,8Bs)-1,8B-Dihydroxy-3A-(3-Hydroxy-4-Methoxyphenyl)-6,8-Dimethoxy-N,N-Dimethyl-3-Phenyl-2,3,3A,8B-Tetrahydro-1H-Cyclopenta[b]Benzofuran-2-Carboxamide

• 英文名称(1R,2R,3S,3Ar,8Bs)-1,8B-Dihydroxy-3A-(3-Hydroxy-4-Methoxyphenyl)-6,8-Dimethoxy-N,N-Dimethyl-3-Phenyl-2,3,3A,8B-Tetrahydro-1H-Cyclopenta[b]Benzofuran-2-Carboxamide
• 中文名称-羟基洛克米兰酰胺
• IUPAC名称(1R,2R,3S,3aR,8bS)-1,8b-dihydroxy-3a-(3-hydroxy-4-methoxyphenyl)-6,8-dimethoxy-N,N-dimethyl-3-phenyl-2,3,3a,8b-tetrahydro-1H-cyclopenta[b]benzofuran-2-carboxamide
• 其它别名3'-Hydroxyrocaglamide; C-3'-Hydroxyrocaglamide; Rocaglamide C; 1H-Cyclopenta[b]Benzofuran-2-Carboxamide, 2,3,3A,8B-Tetrahydro-1,8B-Dihydroxy-3A-(3-Hydroxy-4-Methoxyphenyl)-6,8-Dimethoxy-N,N-Dimethyl-3-Phenyl-, (1R,2R,3S,3Ar,8Bs)-; Rocaglamide D
• CAS编号189322-67-6
• MFCD编号:MFCD08702699
• 分子式:C29H31NO8分子量:521.57
• 产品CID: 959162
• 产品分类天然产物 → 生物碱

• 相似结构搜索
• 产品信息参考;;;;
• InChIKey: VOSHNPGEFUCUHH-IDAMAFBJSA-N
• InChI=1S/C29H31NO8/c1-30(2)27(33)23-24(16-9-7-6-8-10-16)29(17-11-12-20(36-4)19(31)13-17)28(34,26(23)32)25-21(37-5)14-18(35-3)15-22(25)38-29/h6-15,23-24,26,31-32,34H,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

• 沸点704.8±60.0 °C(预测)
• 密度1.368±0.06 g/cm3(预测)
• pKa:9.85±0.10(预测)
• PSA:117.92
• LogP:2.7562
• 溶解性Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
• 外观形态白色至类白色粘性固体

MSDS等安全信息

• 警示词Warning
• 危险描述H302-H315-H319-H335-
• 防范说明P261-P305+P351+P338-

合成工艺路线路线简述

海关参考信息

• 2902600000-乙苯
  2902700000-异丙基苯
  2905122000-异丙醇
  2905310000-1,2-乙二醇
• 💡 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