SpegatrineCAS# 47326-53-4 |
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3D structure
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| Cas No. | 47326-53-4 | SDF | Download SDF |
| PubChem ID | 6441055 | Appearance | Powder |
| Formula | C20H25N2O2 | M.Wt | 325.4 |
| Type of Compound | Alkaloids | Storage | Desiccate at -20°C |
| Solubility | Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc. | ||
| SMILES | CC=C1C[N+]2(C3CC1C(C2CC4=C3NC5=C4C=C(C=C5)O)CO)C | ||
| Standard InChIKey | DOTYYDUNWITJSJ-SYMHJQAPSA-O | ||
| Standard InChI | InChI=1S/C20H24N2O2/c1-3-11-9-22(2)18-8-15-14-6-12(24)4-5-17(14)21-20(15)19(22)7-13(11)16(18)10-23/h3-6,13,16,18-19,21,23H,7-10H2,1-2H3/p+1/b11-3-/t13-,16-,18?,19+,22?/m1/s1 | ||
| General tips | For obtaining a higher solubility , please warm the tube at 37 ℃ and shake it in the ultrasonic bath for a while.Stock solution can be stored below -20℃ for several months. We recommend that you prepare and use the solution on the same day. However, if the test schedule requires, the stock solutions can be prepared in advance, and the stock solution must be sealed and stored below -20℃. In general, the stock solution can be kept for several months. Before use, we recommend that you leave the vial at room temperature for at least an hour before opening it. |
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| About Packaging | 1. The packaging of the product may be reversed during transportation, cause the high purity compounds to adhere to the neck or cap of the vial.Take the vail out of its packaging and shake gently until the compounds fall to the bottom of the vial. 2. For liquid products, please centrifuge at 500xg to gather the liquid to the bottom of the vial. 3. Try to avoid loss or contamination during the experiment. |
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| Shipping Condition | Packaging according to customer requirements(5mg, 10mg, 20mg and more). Ship via FedEx, DHL, UPS, EMS or other couriers with RT, or blue ice upon request. | ||
| Description | Spegatrine is a natural product from Rauvolfia verticillata. |
| Structure Identification | Phytochemistry. 2015 Jan;109:84-95.Indole alkaloids from the Marquesan plant Rauvolfia nukuhivensis and their effects on ion channels.[Pubmed: 25468537]
In addition to the already reported nukuhivensiums 1 and 2, 11 indole alkaloids were isolated from the bark of the plant Rauvolfia nukuhivensis, growing in the Marquesas archipelago.
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Spegatrine Dilution Calculator
Spegatrine Molarity Calculator
| 1 mg | 5 mg | 10 mg | 20 mg | 25 mg | |
| 1 mM | 3.0731 mL | 15.3657 mL | 30.7314 mL | 61.4628 mL | 76.8285 mL |
| 5 mM | 0.6146 mL | 3.0731 mL | 6.1463 mL | 12.2926 mL | 15.3657 mL |
| 10 mM | 0.3073 mL | 1.5366 mL | 3.0731 mL | 6.1463 mL | 7.6829 mL |
| 50 mM | 0.0615 mL | 0.3073 mL | 0.6146 mL | 1.2293 mL | 1.5366 mL |
| 100 mM | 0.0307 mL | 0.1537 mL | 0.3073 mL | 0.6146 mL | 0.7683 mL |
| * Note: If you are in the process of experiment, it's necessary to make the dilution ratios of the samples. The dilution data above is only for reference. Normally, it's can get a better solubility within lower of Concentrations. | |||||
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Indole alkaloids from the Marquesan plant Rauvolfia nukuhivensis and their effects on ion channels.[Pubmed:25468537]
Phytochemistry. 2015 Jan;109:84-95.
In addition to the already reported nukuhivensiums 1 and 2, 11 indole alkaloids were isolated from the bark of the plant Rauvolfia nukuhivensis, growing in the Marquesas archipelago. The known sandwicine (3), isosandwicine (4), Spegatrine (8), lochneram (9), flavopereirine (13) have been found in this plant together with the norsandwicine (5), isonorsandwicine (6), Nb-methylisosandwicine (7), 10-methoxypanarine (10), nortueiaoine (11), tueiaoine (12). The structure elucidation was performed on the basis of a deep exploration of the NMR and HRESIMS data as well as comparison with literature data for similar compounds. Norsandwicine, 10-methoxypanarine, tueiaoine, and more importantly nukuhivensiums, were shown to significantly induce a reduction of IKr amplitude (HERG current). Molecular modelling through docking was performed in order to illustrate this result.
