烟碱 1'-N-氧化物结构式
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常用名 | 烟碱 1'-N-氧化物 | 英文名 | Nicotine 1'-N-oxide |
|---|---|---|---|---|
| CAS号 | 491-26-9 | 分子量 | 178.23100 | |
| 密度 | N/A | 沸点 | N/A | |
| 分子式 | C10H14N2O | 熔点 | N/A | |
| MSDS | N/A | 闪点 | N/A |
| 中文名 | 烟碱 1'-N-氧化物 |
|---|---|
| 英文名 | nicotine-1'-N-oxide |
| 英文别名 | 更多 |
| 分子式 | C10H14N2O |
|---|---|
| 分子量 | 178.23100 |
| 精确质量 | 178.11100 |
| PSA | 42.32000 |
| LogP | 1.81970 |
| InChIKey | RWFBQHICRCUQJJ-NUHJPDEHSA-N |
| SMILES | C[N+]1([O-])CCCC1c1cccnc1 |
| 烟碱 1'-N-氧化物上游产品 0 | |
|---|---|
| 烟碱 1'-N-氧化物下游产品 3 | |
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实验名称:Inhibition Assay from US Patent US8609708: "Synthetic compounds and derivatives as mo...
来源:BindingDB
靶标:N/A
External Id:BindingDB_6119_1
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实验名称:Inhibition of human CYP2A6 expressed in insect cell microsomes assessed as reduction ...
来源:ChEMBL
靶标:Cytochrome P450 2A6
External Id:CHEMBL4422401
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实验名称:Selectivity index, ratio of IC50 for inhibition of human CYP3A4 assessed as reduction...
来源:ChEMBL
靶标:N/A
External Id:CHEMBL4422402
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实验名称:Inhibition of CYP3A4 in human liver microsomes assessed as reduction in enzyme-mediat...
来源:ChEMBL
靶标:Cytochrome P450 3A4
External Id:CHEMBL4422403
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| nicotine-N-oxide |
| 3-(1-methyl-1-oxy-pyrrolidin-2-yl)-pyridine |
| nicotine 1'-oxide |
| 3-(1-Methyl-1-oxy-pyrrolidin-2-yl)-pyridin |
| (1'S,2'S)-NICOTINE 1'-OXIDE |
| MFCD00869528 |