58253-27-3
(5-羟基-1-(4-羟基-3-甲氧基-环己基)癸烷-3-酮,Gingerol)
5-羟基-1-(4-羟基-3-甲氧基-环己基)癸烷-3-酮
Gingerol
58253-27-3
C18H28O4
308.41252
名称和标识符
InChIKey | ONQQLFWDTJJQKU-UHFFFAOYSA-N |
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Inchi | InChI=1S/C17H32O4/c1-3-4-5-6-14(18)12-15(19)9-7-13-8-10-16(20)17(11-13)21-2/h13-14,16-18,20H,3-12H2,1-2H3 |
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SMILES | CCCCCC(CC(=O)CCC1CCC(C(C1)OC)O)O |
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别名信息
- 中文别名 -
- 5-羟基-1-(4-羟基-3-甲氧基-环己基)癸-3-酮
- 5-羟基-1-(4-羟基-3-甲氧基-环己基)癸烷-3-酮
- 英文别名 -
- Gingerol
- 5-HYDROXY-1-(4-HYDROXY-3-METHOXY-CYCLOHEXYL)DECAN-3-ONE
- NS00124116
- 58253-27-3
- 5-Hydroxy-1-(4-hydroxy-3-methoxycyclohexyl)decan-3-one
物化性质
实验特性
沸点 | 453 °C at 760 mmHg |
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闪点 | 159 °C |
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密度 | 1.0713 |
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计算特性
精确分子量 | 300.23006 |
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氢键供体数量 | 2 |
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氢键受体数量 | 4 |
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可旋转化学键数量 | 10 |
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同位素质量 | 300.23006 |
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重原子数量 | 21 |
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复杂度 | 293 |
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同位素原子数量 | 0 |
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确定原子立构中心数量 | 0 |
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不确定原子立构中心数量 | 4 |
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确定化学键立构中心数量 | 0 |
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不确定化学键立构中心数量 | 0 |
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共价键单元数量 | 1 |
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疏水参数计算参考值(XlogP) | 2.3 |
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拓扑分子极性表面积 | 66.8 |
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相关文献
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Sara Hassan Hassan Ahmed,Tímea Gonda,Attila Hunyadi RSC Adv. 2021 11 26687 - 3. 6-Gingerol modulates proinflammatory responses in dextran sodium sulfate (DSS)-treated Caco-2 cells and experimental colitis in mice through adenosine monophosphate-activated protein kinase (AMPK) activation
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Yi Shao,Yao Yu,Cheng Li,Jing Yu,Rongrong Zong,Chonggang Pei RSC Adv. 2016 6 12235 - 5. Electrochemical detection and quantification of gingerol species in ginger (Zingiber officinale) using multiwalled carbon nanotube modified electrodes
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Thing-Fong Tzeng,Shorong-Shii Liou,I.-Min Liu RSC Adv. 2014 4 61427 - 7. Vasculoprotective effects of ginger (Zingiber officinale Roscoe) and underlying molecular mechanisms
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Luyun Cai,Yanbo Wang,Ailing Cao,Yanfang Lv,Jianrong Li RSC Adv. 2015 5 36882 - 10. Cross-talk between 10-gingerol and its anti-cancerous potential: a recent update
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