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胡麻属苷 | 117479-87-5

胡麻属苷结构式图片|117479-87-5结构式图片
中文名称:胡麻属苷
英文名称:Sesamoside
CAS No.:117479-87-5 分子式:C17H24O12 分子量:420.3653
植物源: 独一味  
如需查看该化合物的详细结构式,mol文件,smile, InChi 请点击:胡麻属苷结构式
价格行情:胡麻属苷价格
胡麻属苷的其他展现形式
  • 相关化合物
獐牙菜苦素 Swertiamarin CAS No.:17388-39-5
獐牙菜苷 Sweroside CAS No.:14215-86-2
玉叶金花甙酸甲酯 Cyclopenta[c]pyran-4-carboxylicacid, 1-(b-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-7-hydroxy-7-methyl-,methyl ester, (1S,4aS,7S,7aS)- CAS No.:64421-27-8
野芝麻新苷 Cyclopenta[c]pyran-4-carboxylicacid, 1-(b-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-4a,6,7-trihydroxy-7-methyl-,methyl ester, (1S,4aR,6S,7R,7aS)- CAS No.:27856-54-8
山栀苷甲酯 shanzhiside methy ester CAS No.:64421-28-9
三栀子甙甲酯 Cyclopenta[c]pyran-4-carboxylicacid, 1-(b-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-5,7-dihydroxy-7-methyl-,(1S,4aS,5R,7S,7aS)- CAS No.:29836-27-9
名称和标识符
Inchi 1S/C17H24O12/c1-16-10-15(28-14-9(21)8(20)7(19)6(3-18)27-14)26-4-5(13(23)25-2)17(10,24)11(22)12(16)29-16/h4,6-12,14-15,18-22,24H,3H2,1-2H3/t6-,7-,8+,9-,10-,11-,12+,14+,15+,16-,17+/m1/s1
InChIKey XZVXEPPPQBLGMQ-HISQCTEXSA-N
SMILES O1[C@@]2([H])[C@]([H])([C@@]3(C(C(=O)OC([H])([H])[H])=C([H])O[C@]([H])([C@]3([H])[C@@]12C([H])([H])[H])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[H]
别名信息
- 中文别名 -
胡麻属苷 胡麻属苷 Sesamoside 胡麻属苷(标准品) 胡麻属苷,Sesamoside,植物提取物,标准品,对照品 胡麻属苷对照品 胡麻属苷(标准品)
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- 英文别名 -
Methyl (1aR,1bS,2S,5aR,6R,6aS)-2-(β-D-glucopyranosyloxy)-5a,6-dihydroxy-1a-methyl-1a,1b,2,5a,6,6a-hexahydrooxireno[4,5]cyclopenta[1,2-c]pyran-5-carboxylate Oxireno[4,5]cyclopenta[1,2-c]pyran-5-carboxylicacid, 2-(b-D-glucopyranosyloxy)-1a,1b,2,5a,6,6a... SESAMOSIDE 2-(β-D-Glucopyranosyloxy)-1a,1b,2,5a,6,6a-hexahydro-5a,6-dihydroxy-1a-methyloxireno(4,5)cyclopenta(1,2-c)pyran-5-carboxylic acid methyl ester. (1aR-(1aα,1bβ,2β,5aβ,6β,6aα))- Oxireno(4,5)cyclopenta(1,2-c)pyran-5-carboxylic acid, 2-(β-D-glucopyranosyloxy)-1a,1b,2,5a,6,6a-hexahydro-5a,6-dihydroxy-1a-methyl-, methyl ester. (1aR-(1aα,1bβ,2β,5aβ,6β,6aα))- (1aR,1bS,2S,5aR,6R,6aS)-2-(beta-D-Glucopyranosyloxy)-1a,1b,2,5a,6,6a-hexahydro-5a,6-dihydroxy-1a-methyloxireno[4,5]cyclopenta[1,2-c]pyran-5-carboxylic acid methyl ester [ "" ] C17H24O12 2-(beta-D-Glucopyranosyloxy)-1a,1b,2,5a,6,6a-hexahydro-5a,6-dihydroxy-1a-methyloxireno(4,5)cyclopenta(1,2-c)pyran-5-carboxylic acid methyl ester. (1aR-(1aalpha,1bbeta,2beta,5abeta,6beta,6aalpha))- W1758 N2284 Methyl 2-(hexopyranosyloxy)-5a,6-dihydroxy-1a-methyl-1a,1b,2,5a,6,6a-hexahydrooxireno[4,5]cyclopenta[1,2-c]pyran-5-carboxylate Oxireno(4,5)cyclopenta(1,2-c)pyran-5-carboxylic acid,
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物化性质
 计算特性
精确分子量 420.12700
氢键供体数量 6
氢键受体数量 12
重原子数量 29
可旋转化学键数量 5
复杂度 713
拓扑分子极性表面积 188
 实验特性
颜色与性状 Powder
密度 1.71
PSA 187.90000
LogP -3.90460
化合物详情(旧版)

InChI

InChI=1S/C17H24O12/c1-16-10-15(28-14-9(21)8(20)7(19)6(3-18)27-14)26-4-5(13(23)25-2)17(10,24)11(22)12(16)29-16/h4,6-12,14-15,18-22,24H,3H2,1-2H3/t6-,7-,8+,9-,10-,11-,12+,14+,15+,16-,17+/m1/s1

SMILES

COC(=O)C1[C@]2(O)[C@H]([C@@H](OC=1)O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)[C@]4(C)[C@@H](O4)[C@H]2O

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胡麻属苷 http://www.biopurify.cn/Phytochemicals/Sesamoside.html

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