去氢毒灰叶酚结构式
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常用名 | 去氢毒灰叶酚 | 英文名 | Dehydrotoxicarol |
|---|---|---|---|---|
| CAS号 | 59086-93-0 | 分子量 | 408.40 | |
| 密度 | 1.5±0.1 g/cm3 | 沸点 | 626.5±55.0 °C at 760 mmHg | |
| 分子式 | C23H20O7 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 221.4±25.0 °C |
去氢毒灰叶酚用途6a,12a-Dehydro-α-toxicarol 是一种天然产物,可从 Amorpha fruticosa 中分离得到。 |
| 中文名 | 6A,12A-二去氢-ALPHA-毒灰叶酚 |
|---|---|
| 英文名 | Dehydrotoxicarol |
| 英文别名 | 更多 |
| 密度 | 1.5±0.1 g/cm3 |
|---|---|
| 沸点 | 626.5±55.0 °C at 760 mmHg |
| 分子式 | C23H20O7 |
| 分子量 | 408.40 |
| 闪点 | 221.4±25.0 °C |
| 精确质量 | 408.120911 |
| PSA | 87.36000 |
| LogP | 5.88 |
| InChIKey | HDDUSYQWBVKRGV-UHFFFAOYSA-N |
| SMILES | COc1cc2c(cc1OC)-c1c(oc3c4c(cc(O)c3c1=O)OC(C)(C)C=C4)CO2 |
| 外观性状 | 黄色粉末 |
| 蒸汽压 | 0.0±1.9 mmHg at 25°C |
| 折射率 | 1.677 |
| 储存条件 | 室温 |
| 危害码 (欧洲) | Xi |
|---|
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~54%
去氢毒灰叶酚 59086-93-0 |
| 文献:Begley, Michael J.; Crombie, Leslie; Hadi, Hamid bin A.; Josephs, Jonathan L. Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1993 , # 21 p. 2605 - 2614 |
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实验名称:Inhibitory concentration against rat Steroid 5-alpha-reductase
来源:ChEMBL
靶标:3-oxo-5-alpha-steroid 4-dehydrogenase 1
External Id:CHEMBL813362
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实验名称:Inhibition of 7,12-dimethylbenz[a]anthracene-induced preneoplastic lesions in a mouse...
来源:ChEMBL
靶标:N/A
External Id:CHEMBL986708
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实验名称:Induction of NADPH:quinone reductase in mouse Hepa-1c1c7 cells assessed as drug level...
来源:ChEMBL
靶标:Quinone oxidoreductase
External Id:CHEMBL986711
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实验名称:Chemoprevention index, ratio of IC50 for mouse Hepa-1c1c7 cells to drug level require...
来源:ChEMBL
靶标:N/A
External Id:CHEMBL986710
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| 6-Hydroxy-9,10-dimethoxy-3,3-dimethyl-3H-chromeno[3,4-b]pyrano[2,3-h]chromen-7(13H)-one |
| 11-hydroxy-6a,12adehydrodeguelin |
| 7a,13a-Didehydrotoxicarol |