3alpha,6beta-Ditigloyloxytropan-7beta-olCAS# 7159-86-6 |
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| Cas No. | 7159-86-6 | SDF | Download SDF |
| PubChem ID | 129644121 | Appearance | Oil |
| Formula | C18H27NO5 | M.Wt | 337.4 |
| Type of Compound | Alkaloids | Storage | Desiccate at -20°C |
| Solubility | Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc. | ||
| Chemical Name | [(1S,3R,5R,6R,7S)-6-hydroxy-8-methyl-7-[(E)-2-methylbut-2-enoyl]oxy-8-azabicyclo[3.2.1]octan-3-yl] (E)-2-methylbut-2-enoate | ||
| SMILES | CC=C(C)C(=O)OC1CC2C(C(C(C1)N2C)OC(=O)C(=CC)C)O | ||
| Standard InChIKey | FRQMNJFBOJQRAQ-LPZDQORVSA-N | ||
| Standard InChI | InChI=1S/C18H27NO5/c1-6-10(3)17(21)23-12-8-13-15(20)16(14(9-12)19(13)5)24-18(22)11(4)7-2/h6-7,12-16,20H,8-9H2,1-5H3/b10-6+,11-7+/t12-,13-,14+,15-,16+/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. | ||
The herbs of Datura metel
| Description | 3alpha,6beta-Ditigloyloxytropan-7beta-ol is a natural product from Datura metel. |
| Structure Identification | Phytochemistry, 1973 , 12 (9) :2197-2201.Biosynthesis of the tigloyl esters in Datura: The role of 2-methylbutyric acid.[Reference: WebLink]
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3alpha,6beta-Ditigloyloxytropan-7beta-ol Dilution Calculator
3alpha,6beta-Ditigloyloxytropan-7beta-ol Molarity Calculator
| 1 mg | 5 mg | 10 mg | 20 mg | 25 mg | |
| 1 mM | 2.9638 mL | 14.8192 mL | 29.6384 mL | 59.2768 mL | 74.096 mL |
| 5 mM | 0.5928 mL | 2.9638 mL | 5.9277 mL | 11.8554 mL | 14.8192 mL |
| 10 mM | 0.2964 mL | 1.4819 mL | 2.9638 mL | 5.9277 mL | 7.4096 mL |
| 50 mM | 0.0593 mL | 0.2964 mL | 0.5928 mL | 1.1855 mL | 1.4819 mL |
| 100 mM | 0.0296 mL | 0.1482 mL | 0.2964 mL | 0.5928 mL | 0.741 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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Biosynthesis of the tigloyl esters in Datura: The role of 2-methylbutyric acid.
Phytochemistry, 1973 , 12 (9) :2197-2201.
Datura innoxia plants were wick fed with (±)-2-methylbutyric acid-[1-14C] and harvested after 7 days. The root alkaloids 3α,6β-ditigloyloxytropane and 3alpha,6beta-Ditigloyloxytropan-7beta-ol were isolated and degraded. In each case the radioactivity was located in the ester carbonyl group indicating that this acid is an intermediate in the biosynthesis of tiglic acid from l-isoleucine. On the other hand, (±)-2-hydroxy-2-methylbutyric acid-[1-14C], which was fed to hydroponic cultures of Datura innoxia alongside isoleucine[U-14C] positive control plants, is not an intermediate.
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