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密蒙花苷 | 20316-62-5

密蒙花苷
Tiliroside
20316-62-5
C30H26O13
594.5196
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:密蒙花苷结构式
329768345
简介
密蒙花苷是一种化学物质,分子式为C30H26O13。
名称和标识符
MDL MFCD00017454
InChIKey DVGGLGXQSFURLP-VWMSDXGPSA-N
Inchi 1S/C30H26O13/c31-16-6-1-14(2-7-16)3-10-22(35)40-13-21-24(36)26(38)27(39)30(42-21)43-29-25(37)23-19(34)11-18(33)12-20(23)41-28(29)15-4-8-17(32)9-5-15/h1-12,21,24,26-27,30-34,36,38-39H,13H2/b10-3+/t21-,24-,26+,27-,30+/m1/s1
SMILES O1[C@]([H])([C@@]([H])([C@]([H])([C@@]([H])([C@@]1([H])C([H])([H])OC(/C(/[H])=C(\[H])/C1C([H])=C([H])C(=C([H])C=1[H])O[H])=O)O[H])O[H])O[H])OC1C(C2=C(C([H])=C(C([H])=C2OC=1C1C([H])=C([H])C(=C([H])C=1[H])O[H])O[H])O[H])=O
别名信息
- 中文别名 -
  • 密蒙花苷
  • 银锻苷
  • 刺蒺藜苷
  • 椴树苷
  • 密蒙花苷,银椴苷
  • 密蒙花苷对照品
  • 银椴甙
  • 银椴苷
  • 银椴苷,Tiliroside,植物提取物,标准品,对照品
  • 椴树苷(标准品)
  • 椴树苷,密蒙花苷
  • 椴树苷,银椴苷
  • 椴树苷Tiliroside
  • 椴树苷对照品
  • 银锻苷(椴树苷,密蒙花苷,刺蒺藜苷),Tiliroside,植物提取物,标准品,对照品
  • 银椴苷;椴树苷(对照品)
- 英文别名 -
  • Tiliroside
  • 5,7-Dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yl 6-O-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]-beta-D-glucopyranoside
  • TILIROSIDE(P)
  • 6'-O-trans-p-CouMaroylastragalin
  • trans-tiliroside
  • Astragalin 6"-trans-p-coumarate
  • Kaempferol 3-O-β-D-(6″-O-(E)-p-coumaroyl)glucopyranoside
  • Potengriffioside A
  • 6''-O-trans-p-Coumaroylastragalin
  • [ "6''-O-trans-p-Coumaroylastragalin" ]
  • Tribuloside
  • 15M04TXR9M
  • 2-Propenoic acid, 3-(4-hydroxyphenyl)-, 6'-ester with 3-(beta-D-glucopyranosyloxy)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
  • Tiliroside, analytical standard
  • MEGxp0_000169
  • [(2R,3S,4S,5R,6S)-6-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate
  • BDBM50
  • Trans-Tiliroside
  • ((2R,3S,4S,5R,6S)-6-((5,7-Dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)methyl (E)-3-(4-hydroxyphenyl)acrylate
  • A814433
  • KAEMPFEROL-3-O(-6-O-TRANS-P-COUMAROYL-.BETA.-GLUCOPYRANOSIDE
  • HY-N2443
  • kaempferol 3-O-(6'-O-p-coumaroyl)-glucoside
  • KAEMPFEROL 3-O-(6''-O-(E)-P-COUMAROYL)-.BETA.-D-GLUCOPYRANOSIDE
  • KAEMPFEROL 3-O-(6''-O-P-COUMAROYL)GLUCOSIDE
  • MS-30569
  • Q-100248
  • kaempferol-3-O-beta-D-(6''-(E)-p-coumaroyl)-glucopyranoside
  • TILIROSIDE [INCI]
  • AKOS015896718
  • 3-O-KAEMPFEROL 6-O-(TRANS-P-COUMAROYL)-.BETA.-D-GLUCOPYRANOSIDE
  • SCHEMBL23597
  • CHEMBL266564
  • GLXC-13144
  • (E)-((2R,3S,4S,5R,6S)-6-(5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yloxy)-3,4,5-trihydroxy-tetrahydro-2H-pyran-2-yl)methyl 3-(4-hydroxyphenyl)acrylate
  • DTXSID601021936
  • 2-PROPENOIC ACID, 3-(4-HYDROXYPHENYL)-, 6'-ESTER WITH 3-(.BETA.-D-GLUCOPYRANOSYLOXY)-5,7-DIHYDROXY-2-(4-HYDROXYPHENYL)-4H-1-BENZOPYRAN-4-ONE, (E)-
  • MFCD00017454
  • 4H-1-BENZOPYRAN-4-ONE, 5,7-DIHYDROXY-2-(4-HYDROXYPHENYL)-3-((6-O-((2E)-3-(4-HYDROXYPHENYL)-1-OXO-2-PROPEN-1-YL)-.BETA.-D-GLUCOPYRANOSYL)OXY)-
  • 5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4E-1-benzopyran-3-yl 6-O-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]-beta-D-glucopyranoside
  • Kaempferol-3-O-(6-O-trans-p-coumaroyl)-.beta.-glucopyranoside
  • C17140
  • KAEMPFEROL 3-O-.BETA.-D-(6-O-TRANS-P-COUMAROYL)GLUCOPYRANOSIDE
  • ((2R,3S,4S,5R,6S)-6-((5,7-Dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)methyl 3-(4-hydroxyphenyl)acrylate
  • [(2R,3S,4S,5R,6S)-6-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-chromen-3-yl]oxy-3,4,5-trihydroxy-tetrahydropyran-2-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate
  • UNII-15M04TXR9M
  • 20316-62-5
  • Kaempferol-3-(p-coumaryl)glucoside
  • 22153-44-2
  • RONACARE TILIROSIDE
  • ASTRAGALIN-6''-TRANS-P-COUMARATE
  • BDBM50241244
  • CHEBI:80944
  • (E)-((2R,3S,4S,5R,6S)-6-(5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yloxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)methyl 3-(4-hydroxyphenyl)acrylate
  • kaempferol 3-O-(6'''' ''''-O-E-p-coumaroyl)-beta-D-glucopyranoside
  • KAEMPFEROL 3-O-(6''-O-(TRANS-P-COUMAROYL))-.BETA.-D-GLUCOPYRANOSIDE
  • CS-0022668
  • NS00097257
  • kaempferol-3-beta-D-(6-O-trans-p-coumaroyl)glucopyranoside
  • 4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[[6-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-.beta.-D-glucopyranosyl]oxy]-
  • NCGC00163634-01
  • Q23418844
  • Tribuloside A
  • Kaempferol 3-(6''-trans-p-coumaroyl)glucoside
  • kaempferol-3-beta-D-(6-O-cis-p-coumaroyl)glucopiranoside
  • Kaempferol 3-(6''-p-coumarylgalactoside)
  • 3,4',5,7-Tetrahydroxyflavone 3-(6''-trans-p-coumaroyl)glucoside
  • kaempferol-3-beta-D-(6-O-trans-p-coumaroyl)glucopiranoside
  • Kaempferol 3-O-beta-D-(6''-coumaroyl)-glucopyranoside
物化性质
实验特性
LogP 1.72540
PSA 216.58000
折射率 1.759
沸点 943.9℃ at 760mmHg
熔点 257-260°C
蒸气压 0.0±0.3 mmHg at 25°C
闪点 华氏:591.8 °F
摄氏:311 °C
颜色与性状 Yellow powder
光学活性 [α]/D -65±8°, c = 0.1 in methanol
密度 1.7±0.1 g/cm3
计算特性
精确分子量 594.13700
氢键供体数量 7
氢键受体数量 13
可旋转化学键数量 8
同位素质量 594.13734088 g/mol
重原子数量 43
复杂度 1040
同位素原子数量 0
确定原子立构中心数量 5
不确定原子立构中心数量 0
确定化学键立构中心数量 1
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) 2.5
拓扑分子极性表面积 213
分子量 594.5
生产方法和用途
用途 1、银椴苷对CU3+诱导的LDL氧化具有拮抗作用,抑制人低密度脂蛋白氧化。
相关文献
专业数据库参考
PubChemId 329768345
参考资料
Reaxys RN
化合物详情(旧版)
 
扩展阅读
银椴苷 http://www.biopurify.cn/Phytochemicals/Tiliroside.html
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