化工网/ CAS号查询/ Olean-12-en-28-oicacid, 3-[(O-6-deoxy-a-L-mannopyranosyl-(1&reg | 106577-39-3

Olean-12-en-28-oicacid, 3-[(O-6-deoxy-a-L-mannopyranosyl-(1&reg | 106577-39-3

Olean-12-en-28-oicacid, 3-[(O-6-deoxy-a-L-mannopyranosyl-(1&reg结构式图片|106577-39-3结构式图片 →现货商城 点击进入
中文名称:Olean-12-en-28-oicacid, 3-[(O-6-deoxy-a-L-mannopyranosyl-(1&reg
英文名称:Hederacolchiside A1
CAS No.:106577-39-3 分子式:C47H76O16 分子量:897.0968
如需查看该化合物的详细结构式,mol文件,smile, InChi 请点击:Olean-12-en-28-oicacid, 3-[(O-6-deoxy-a-L-mannopyranosyl-(1&reg结构式
价格行情:Olean-12-en-28-oicacid, 3-[(O-6-deoxy-a-L-mannopyranosyl-(1&reg价格
名称和标识符
Inchi 1S/C47H76O16/c1-22-30(49)33(52)35(54)38(59-22)63-37-32(51)26(61-39-36(55)34(53)31(50)25(20-48)60-39)21-58-40(37)62-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25+,26-,27-,28+,29-,30-,31+,32-,33+,34-,35+,36+,37+,38-,39-,40-,44-,45+,46+,47-/m0/s1
InChIKey FYSAXYBPXKLMJO-IFECXJOTSA-N
SMILES O([C@@]1([H])[C@@]([H])([C@]([H])([C@]([H])(C([H])([H])O1)O[C@@]1([H])[C@@]([H])([C@]([H])([C@@]([H])([C@@]([H])(C([H])([H])O[H])O1)O[H])O[H])O[H])O[H])O[C@@]1([H])[C@@]([H])([C@@]([H])([C@]([H])([C@]([H])(C([H])([H])[H])O1)O[H])O[H])O[H])[C@@]1([H])C([H])([H])C([H])([H])[C@@]2(C([H])([H])[H])[C@@]([H])(C([H])([H])C([H])([H])[C@@]3(C([H])([H])[H])[C@]4(C([H])([H])[H])C([H])([H])C([H])([H])[C@@]5(C(=O)O[H])C([H])([H])C([H])([H])C(C([H])([H])[H])(C([H])([H])[H])C([H])([H])[C@@]5([H])C4=C([H])C([H])([H])[C@@]32[H])C1(C([H])([H])[H])C([H])([H])[H]
别名信息
- 中文别名 -
黑海常春藤苷A1 HEDERACOLCHISIDE A1(标准品) 臭灵丹二醇
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- 英文别名 -
4)]-a-L-arabinopyranosyl)oxy]-, (3b)- Hederacolchiside A1 Oleanolic acid-3-O-a-L-rhamnopyranosyl-(1-> 2)-[b-D-glucopyranosyl-(1-> 4)]-a-L-arabinopyranoside Raddeanoside R13 8191AH N2047 Oleanolic acid 3-o-beta-D-glucosyl-(1->3)-alpha-L-ramnosyl(1->2)-alpha-L-arabinoside
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物化性质
 计算特性
氢键供体数量 9
氢键受体数量 16
重原子数量 63
可旋转化学键数量 8
复杂度 1720
疏水参数计算参考值(XlogP) 3.3
拓扑分子极性表面积 255
 实验特性
颜色与性状 Powder
密度 1.36±0.1 g/cm3 (20 ºC 760 Torr),
熔点 253-255 ºC (methanol , water )
溶解度 Insuluble (3.9E-4 g/L) (25 ºC),
化合物详情(旧版)
 
扩展阅读
Hederacolchiside A1 http://www.biopurify.cn/p-2797.html

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