CAS: 53755-76-3; (2R,3S,4Ar,7As,9Ar,10S,11R,13Ar,13Bs,15As,15Br)-10-(Hydroxymethyl)-4,4,7A,10,13A,15B-Hexamethyl-2,3,4,4A,5,7,7A,8,9,9A,10,11,12,13,13A,13B,14,15,15A,15B-Icosahydro-1H-Cyclohepta[1,2-A:5,4-A']Dinaphthalene-2,3,11-Triol

• 英文名称(2R,3S,4Ar,7As,9Ar,10S,11R,13Ar,13Bs,15As,15Br)-10-(Hydroxymethyl)-4,4,7A,10,13A,15B-Hexamethyl-2,3,4,4A,5,7,7A,8,9,9A,10,11,12,13,13A,13B,14,15,15A,15B-Icosahydro-1H-Cyclohepta[1,2-A:5,4-A']Dinaphthalene-2,3,11-Triol
• 中文名称伸筋草萜宁醇
• IUPAC名称(2R,3S,4aR,7aS,9aR,10S,11R,13aR,13bS,15aS,15bR)-10-(hydroxymethyl)-4,4,7a,10,13a,15b-hexamethyl-2,3,4,4a,5,7,7a,8,9,9a,10,11,12,13,13a,13b,14,15,15a,15b-icosahydro-1H-cyclohepta[1,2-a:5,4-a']dinaphthalene-2,3,11-triol
• 其它别名(4S)-C(14A)-Homo-27-Norgammacer-14-Ene-3α,20β,21β,23-Tetrol; Lyclaninol; Lyclanil; 1H-Cyclohepta[1,2-A:5,4-A']Dinaphthalene-2,3,11-Triol, 2,3,4,4A,5,7,7A,8,9,9A,10,11,12,13,13A,13B,14,15,15A,15B-Eicosahydro-10-(Hydroxymethyl)-4,4,7A,10,13A,15B-Hexamethyl-, (2R,3S,4Ar,7As,9Ar,10S,11R,13Ar,13Bs,15As,15Br)-
• CAS编号53755-76-3
• MFCD编号:MFCD17214903
• 分子式:C30H50O4分子量:474.73
• 产品CID: 2511944
• 产品分类天然产物 → 萜类

• 相似结构搜索
• 产品信息参考;;
• InChIKey: MRQRSMCZZRLXJG-AGTZBQNOSA-N
• InChI=1S/C30H50O4/c1-26(2)21-9-7-18-15-27(3)13-11-23-28(4,14-12-24(33)30(23,6)17-31)22(27)10-8-19(18)29(21,5)16-20(32)25(26)34/h7,19-25,31-34H,8-17H2,1-6H3/t19-,20+,21-,2
• 计算化学: 氢键受体数4.0氢键供体数4.0可旋转键数1.0

物理性质

• 沸点582.4±50.0 °C(预测)
• 闪点238.9±24.7 °C
• 密度1.14±0.1 g/cm3(预测)
• pKa:14.61±0.70(预测)
• PSA:80.92
• LogP:5.0829
• 产品应用该化合物是中医使用中医中脊髓灰质炎.

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
• 安全声明H303+H313+H333

上下游产品

合成工艺路线路线简述

海关参考信息

• 2901210000-乙烯
  2901220000-丙烯
  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