CAS: 90468-72-7; ((1R,4Ar,5S,6S,6As,7S,8S,9R,11As,11Bs)-5-Acetoxy-1,6,7,8-Tetrahydroxy-4,4-Dimethyldodecahydro-1H-6,11B-(Epoxymethano)-6A,9-Methanocyclohepta[a]Naphthalen-8-yl)Methyl Acetate

• 英文名称((1R,4Ar,5S,6S,6As,7S,8S,9R,11As,11Bs)-5-Acetoxy-1,6,7,8-Tetrahydroxy-4,4-Dimethyldodecahydro-1H-6,11B-(Epoxymethano)-6A,9-Methanocyclohepta[a]Naphthalen-8-yl)Methyl Acetate
• 中文名称毛叶香茶菜素
• IUPAC名称((1R,4aR,5S,6S,6aS,7S,8S,9R,11aS,11bS)-5-acetoxy-1,6,7,8-tetrahydroxy-4,4-dimethyldodecahydro-1H-6,11b-(epoxymethano)-6a,9-methanocyclohepta[a]naphthalen-8-yl)methyl acetate
• 其它别名(1Beta,6Beta,7Alpha,15Beta,16Alpha)-7,20-Epoxykaurane-1,6,7,15,16,17-Hexol 6,17-Diacetate; Maoyerabdosin; Kaurane-1,6,7,15,16,17-Hexol, 7,20-Epoxy-, 6,17-Diacetate, (1β,6β,7α,15β,16α)-
• CAS编号90468-72-7
• MFCD编号:MFCD26406100
• 分子式:C24H36O9分子量:468.54
• 产品CID: 1937584
• 产品分类天然产物 → 萜类

• 相似结构搜索
• InChIKey: CMGWGNNIXJOCTA-ZEHIXQIYSA-N
• InChI=1S/C24H36O9/c1-12(25)31-11-23(29)14-5-6-15-21-10-32-24(30,22(15,9-14)19(23)28)18(33-13(2)26)17(21)20(3,4)8-7-16(21)27/h14-19,27-30H,5-11H2,1-4H3/t14-,15+,16-,17-,18
• 计算化学: 氢键受体数9.0氢键供体数4.0可旋转键数5.0

物理性质

• 沸点607.4±55.0 °C at 760 mmHg
• 闪点202.3±25.0 °C
• 密度1.4±0.1 g/cm3
• pKa:11.52±0.70(预测)
• PSA:142.75
• LogP:1.12
• 折射率1.599
• 蒸汽压0.0±3.9 mmHg at 25°C
• 外观形态粉末
• 储存条件室温

MSDS等安全信息

• 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P264+P280+P305+P351+P338+P337+P313
• 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
  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