CAS: 81263-97-0; (2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydro-2H-Pyran-2-Yl (4R,4As,5R,6As,9S,11S,11As,11Bs)-5,11-Dihydroxy-4,11B-Dimethyl-8-Methylene-7-Oxotetradecahydro-6A,9-Methanocyclohepta[a]Naphthalene-4-Carboxylate

• 英文名称(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydro-2H-Pyran-2-Yl (4R,4As,5R,6As,9S,11S,11As,11Bs)-5,11-Dihydroxy-4,11B-Dimethyl-8-Methylene-7-Oxotetradecahydro-6A,9-Methanocyclohepta[a]Naphthalene-4-Carboxylate
• 中文名称等效-6,11-二羟基-15-氧代-16-贝壳杉烯-19-酸 β-D-吡喃葡萄糖酯
• IUPAC名称(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl (4R,4aS,5R,6aS,9S,11S,11aS,11bS)-5,11-dihydroxy-4,11b-dimethyl-8-methylene-7-oxotetradecahydro-6a,9-methanocyclohepta[a]naphthalene-4-carboxylate
• 其它别名Ent-6,11-Dihydroxy-15-Oxo-16-Kauren-19-Oic Acid Beta-D-Glucopyrasyl Ester; Ent-6,11-Dihydroxy-15-Oxo-16-Kauren-19-Oic Acid Beta-D-Glucopyranosyl Ester; Ent-6,11-Dihydroxy-15-Oxokaur-16-En-19-Oic Acid β-D-Glucopyranosyl Ester; 6β-Hydroxypaniculoside Iii; 6Beta-Hydroxypaniculoside Iii; Ent-6,11-Dihydroxy-15-Oxokaur-16; Ent-6α,11α-Dihydroxy-15-Oxo-16-Kauren-19-Oic Acid β-D-Glucopyranosyl Ester; Kaur-16-En-18-Oic Acid, 6,11-Dihydroxy-15-Oxo-, β-D-Glucopyranosyl Ester, (4α,6β,11β)- (9Ci)
• CAS编号81263-97-0
• MFCD编号:MFCD20274653
• 分子式:C26H38O10分子量:510.58
• 产品CID: 1806618
• 产品分类天然产物 → 萜类

• 相似结构搜索
• 产品信息参考;;
• InChIKey: OIMCIPSRGXJJFP-OHHFPUJUSA-N
• InChI=1S/C26H38O10/c1-11-12-7-13(28)20-24(2)5-4-6-25(3,19(24)14(29)9-26(20,8-12)21(11)33)23(34)36-22-18(32)17(31)16(30)15(10-27)35-22/h12-20,22,27-32H,1,4-10H2,2-3H3/t12-
• 计算化学: 氢键受体数10.0氢键供体数6.0可旋转键数4.0

物理性质

• 沸点713.4±60.0 °C at 760 mmHg
• 闪点236.9±26.4 °C
• 密度1.4±0.1 g/cm3
• pKa:12.51±0.70(预测)
• PSA:173.98
• LogP:0.06
• 折射率1.624
• 蒸汽压0.0±5.2 mmHg at 25°C
• 溶解性Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
• 外观形态结晶
• 储存条件2-8°C，密封保存，干燥环境，避光

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

• 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