CAS: 81678-46-8; (3'R,4S,5R,5'S,10S,13S,14S,17S)-4-(Hydroxymethyl)-3',4,10,13,14-Pentamethyl-5'-Propionyl-1,4,4',5,5',6,7,10,11,12,13,14,15,16-Tetradecahydro-3'H-Spiro[cyclopenta[a]Phenanthrene-17,2'-Furan]-3(2H)-One

• 英文名称(3'R,4S,5R,5'S,10S,13S,14S,17S)-4-(Hydroxymethyl)-3',4,10,13,14-Pentamethyl-5'-Propionyl-1,4,4',5,5',6,7,10,11,12,13,14,15,16-Tetradecahydro-3'H-Spiro[cyclopenta[a]Phenanthrene-17,2'-Furan]-3(2H)-One
• 中文名称(4β,23S)-17,23-环氧-28-羟基-27-去甲羊毛甾-8-烯-3,24-二酮
• IUPAC名称(3'R,4S,5R,5'S,10S,13S,14S,17S)-4-(hydroxymethyl)-3',4,10,13,14-pentamethyl-5'-propionyl-1,4,4',5,5',6,7,10,11,12,13,14,15,16-tetradecahydro-3'H-spiro[cyclopenta[a]phenanthrene-17,2'-furan]-3(2H)-one
• 其它别名(23S)-17,23-Epoxy-29-Hydroxy-27-Nor-5α-Lanost-8-Ene-3,24-Dione; 3-Dehydro-15-Deoxoeucosterol; (4Beta,23S)-17,23-Epoxy-28-Hydroxy-27-Norlanost-8-Ene-3,24-Dione; 17,23-Epoxy-29-Hydroxy-27-Norlanost-8-Ene-3,24-Dione; 27-Norlanost-8-Ene-3,24-Dione, 17,23-Epoxy-28-Hydroxy-, (4β,23S)-
• CAS编号81678-46-8
• MFCD编号:MFCD20260975
• 分子式:C29H44O4分子量:456.67
• 产品CID: 1809636
• 产品分类天然产物 → 萜类

• 相似结构搜索
• InChIKey: KHSHJGYTLGFEMC-LBQQCSDXSA-N
• InChI=1S/C29H44O4/c1-7-21(31)22-16-18(2)29(33-22)15-14-27(5)20-8-9-23-25(3,19(20)10-13-28(27,29)6)12-11-24(32)26(23,4)17-30/h18,22-23,30H,7-17H2,1-6H3/t18-,22+,23-,25-,26
• 计算化学: 氢键受体数4.0氢键供体数1.0可旋转键数3.0

物理性质

• 沸点573.9±50.0 °C at 760 mmHg
• 闪点182.0±23.6 °C
• 密度1.1±0.1 g/cm3
• pKa:14.29±0.10(预测)
• PSA:63.6
• LogP:5.04
• 折射率1.553
• 蒸汽压0.0±3.6 mmHg at 25°C
• 外观形态粉末
• 储存条件2-8°C，干燥环境，密闭

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
• 危险品标志Xi
• 安全声明H303+H313+H333

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
  2905143000-叔丁醇
• 💡 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