CAS: 167875-39-0; (1S,2R,4As,6Ar,6Br,8Ar,10S,12Ar,12Br,14Bs)-10-(((2R,3R,4R,5R,6R)-3,4-Dihydroxy-6-Methyl-5-(((2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydro-2H-Pyran-2-yl)Oxy)Tetrahydro-2H-Pyran-2-yl)Oxy)-1,2,6B,9,9,12A-Hexamethyl-1,2,3,4,5,6,6B,7,8,8A,9,10,11,12,12A,12B,13,14B-Octadecahydropicene-4A,6A-Dicarboxylic Acid

• 英文名称(1S,2R,4As,6Ar,6Br,8Ar,10S,12Ar,12Br,14Bs)-10-(((2R,3R,4R,5R,6R)-3,4-Dihydroxy-6-Methyl-5-(((2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydro-2H-Pyran-2-yl)Oxy)Tetrahydro-2H-Pyran-2-yl)Oxy)-1,2,6B,9,9,12A-Hexamethyl-1,2,3,4,5,6,6B,7,8,8A,9,10,11,12,12A,12B,13,14B-Octadecahydropicene-4A,6A-Dicarboxylic Acid
• IUPAC名称(1S,2R,4aS,6aR,6bR,8aR,10S,12aR,12bR,14bS)-10-(((2R,3R,4R,5R,6R)-3,4-dihydroxy-6-methyl-5-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-1,2,6b,9,9,12a-hexamethyl-1,2,3,4,5,6,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a,6a-dicarboxylic acid
• 其它别名Rubelloside B; Urs-12-Ene-27,28-Dioicacid, 3-[(6-Deoxy-4-O-B-D-Glucopyranosyl-B-D-Galactopyranosyl)Oxy]-, (3B)-; (3Beta)-3-[(6-Deoxy-4-O-Beta-D-Glucopyranosyl-Beta-D-Galactopyranosyl)Oxy]Urs-12-Ene-27,28-Dioic Acid; Urs-12-Ene-27,28-Dioic Acid, 3-[(6-Deoxy-4-O-β-D-Glucopyranosyl-β-D-Galactopyranosyl)Oxy]-, (3β)-
• CAS编号167875-39-0
• MFCD编号:MFCD20260661
• 分子式:C42H66O14分子量:794.98
• 产品CID: 848816
• 产品分类天然产物 → 萜类

• 相似结构搜索
• 产品信息参考;;;;
• InChIKey: IIIOQVDDEWZCEQ-WJMBNSPDSA-N
• InChI=1S/C42H66O14/c1-19-10-15-41(36(49)50)16-17-42(37(51)52)22(27(41)20(19)2)8-9-25-39(6)13-12-26(38(4,5)24(39)11-14-40(25,42)7)55-34-32(48)30(46)33(21(3)53-34)56-35-31(
• 计算化学: 氢键受体数14.0氢键供体数8.0可旋转键数7.0

物理性质

• 沸点912.8±65.0 °C at 760 mmHg
• 闪点269.1±27.8 °C
• 密度1.4±0.1 g/cm3
• PSA:232.9
• LogP:2.8302

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

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