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皂草苷 | 20310-89-8

皂草苷结构式图片|20310-89-8结构式图片
皂草苷
Saponarin
20310-89-8
C27H30O15
594.5181
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:皂草苷结构式
皂草苷MSDS
441381
皂草苷价格
简介
Saponarin 是一种从 Gypsophila trichotoma 中分离出的天然的黄酮类化合物,具有抗氧化、抗炎和保护肝脏的作用。Saponarin 以钙依赖的方式激活AMPK,从而调节糖异生和葡萄糖摄取。
名称和标识符
MDL MFCD00238679
InChIKey HGUVPEBGCAVWID-KETMJRJWSA-N
Inchi 1S/C27H30O15/c28-7-15-19(32)22(35)24(37)26(40-15)18-14(41-27-25(38)23(36)20(33)16(8-29)42-27)6-13-17(21(18)34)11(31)5-12(39-13)9-1-3-10(30)4-2-9/h1-6,15-16,19-20,22-30,32-38H,7-8H2/t15-,16-,19-,20-,22+,23+,24-,25-,26+,27-/m1/s1
SMILES O1[C@]([H])(C([H])([H])O[H])[C@]([H])([C@@]([H])([C@]([H])([C@]1([H])C1C(=C2C(C([H])=C(C3C([H])=C([H])C(=C([H])C=3[H])O[H])OC2=C([H])C=1O[C@@]1([H])[C@@]([H])([C@]([H])([C@@]([H])([C@@]([H])(C([H])([H])O[H])O1)O[H])O[H])O[H])=O)O[H])O[H])O[H])O[H]
别名信息
- 中文别名 -
  • 皂草苷
  • 肥皂草苷
  • 皂草苷,皂草黄苷
  • 皂草黄苷
  • 皂草甙
- 英文别名 -
  • 4H-1-Benzopyran-4-one,6-b-D-glucopyranosyl-7-(b-D-glucopyranosyloxy)-5-hydroxy-2-(4-hydroxyphenyl)-
  • 4H-1-Benzopyran-4-one,6-b-D-glucopyranosyl-7-(b-D-glucopyranosyloxy)-5-hydroxy-2-(4-hydroxyphe...
  • 5-hydroxy-2-(4-hydroxyphenyl)-6-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-7-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
  • Saponarin
  • SAPONARIN(AS)
  • 7-O-(beta-D-glucosyl)isovitexin
  • apigenin-6-C,7-O-diglucoside
  • isovitexin-7-O-glucoside
  • Saponaretin-7-O-glucoside
  • 4′,5,7-Trihydroxyflavone 6-C-glucoside 7-O-glucoside
  • 7-O-Glucosylisovitexin
  • Isovitexin 7-glucoside
  • Petrocomoside
  • Isovitexin-7-O-beta-D-glucopyranoside
  • isovitexin 7-O-glucoside
  • 3081Z76OX9
  • HGUVPEBGCAVWID-KETMJRJWSA-N
  • Apigenin 6-C-glucosyl-7-O-glucoside
  • Apigenin-6-C-glucoside -7-O-glucoside
  • 4H-1-Benzopyran-4-one, 6-.beta.-D-glucopyranosyl-7-(.beta.-D-glucopyranosyloxy)-5-hydroxy-2-(4-hydroxyp
  • 6-C-GLUCOSYL-7-O-GLUCOSYLAPIGENIN
  • DTXSID10174201
  • 4H-1-Benzopyran-4-one, 3-((6-O-(6-deoxy-beta-L-mannofuranosyl)-beta-O-galactofuranosyl)oxy)-7-((6-deoxy-beta-L-mannopyranosyl)oxy)-5-hydroxy-2-(4-hydroxyphenyl)-
  • 5-hydroxy-2-(4-hydroxyphenyl)-6-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]-7-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chromen-4-one
  • 6-.BETA.-D-GLUCOPYRANOSYL-7-(.BETA.-D-GLUCOPYRANOSYLOXY)-5-HYDROXY-2-(4-HYDROXYPHENYL)-4H-1-BENZOPYRAN-4-ONE
  • Isovitexin-7-O-glucoside
  • 7-O-GLUCOSYLISOVITEXIN
  • ISOVITEXIN 7-.BETA.-D-GLUCOSIDE
  • UNII-3081Z76OX9
  • SCHEMBL2489122
  • 4H-1-Benzopyran-4-one, 6-.beta.-D-glucopyranosyl-7-(.beta.-D-glucopyranosyloxy)-5-hydroxy-2-(4-hydroxyphenyl)-
  • 20310-89-8
  • 5-hydroxy-2-(4-hydroxyphenyl)-6-((2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)-7-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one
  • AKOS037514829
  • CHEMBL4640510
  • CHEBI:75439
  • ISOVITEXIN 7-GLUCOSIDE
  • CS-0032401
  • CCG-208416
  • ISOVITEXIN 7-.BETA.-D-GLUCOPYRANOSIDE
  • C08064
  • SR-05000002259-2
  • (1S)-1,5-anhydro-1-[7-(beta-D-glucopyranosyloxy)-5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-6-yl]-D-glucitol
  • 5-hydroxy-2-(4-hydroxyphenyl)-6-((2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)-7-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yloxy)-4H-chromen-4-one
  • AC1L9B2G
  • SR-05000002259
  • SAPONARIN [MI]
  • Q63408652
  • MS-30560
  • HY-N5083
  • MFCD00238679
物化性质
实验特性
LogP -2.43520
PSA 260.20000
折射率 1.728
沸点 919.5 °C at 760 mmHg
熔点 240-242 ºC
蒸气压 0.0±0.3 mmHg at 25°C
闪点 305.4 °C
溶解度 Very 微溶 (0.17 g/L) (25 ºC),
颜色与性状 Yellow powder
密度 1.723±0.06 g/cm3 (20 ºC 760 Torr),
计算特性
精确分子量 594.15800
氢键供体数量 10
氢键受体数量 15
可旋转化学键数量 6
同位素质量 594.158
重原子数量 42
复杂度 971
同位素原子数量 0
确定原子立构中心数量 10
不确定原子立构中心数量 0
确定化学键立构中心数量 0
不确定化学键立构中心数量 0
共价键单元数量 1
疏水参数计算参考值(XlogP) -1.6
拓扑分子极性表面积 256
分子量 594.5
相关文献
专业数据库参考
PubChemId 441381
参考资料
Reaxys RN
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