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3Beta-Isodihydrocadambine 4-oxide

CAS# 1092371-18-0

3Beta-Isodihydrocadambine 4-oxide

Catalog No. BCN3651----Order now to get a substantial discount!

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3Beta-Isodihydrocadambine 4-oxide: 5mg $1098 In Stock
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Quality Control of 3Beta-Isodihydrocadambine 4-oxide

Number of papers citing our products

Chemical structure

3Beta-Isodihydrocadambine 4-oxide

3D structure

Chemical Properties of 3Beta-Isodihydrocadambine 4-oxide

Cas No. 1092371-18-0 SDF Download SDF
PubChem ID 102004692 Appearance Powder
Formula C27H34N2O11 M.Wt 562.6
Type of Compound Alkaloids Storage Desiccate at -20°C
Solubility Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
SMILES COC(=O)C1=COC(C2C1CC3C4=C(CC[N+]3(C2CO)[O-])C5=CC=CC=C5N4)OC6C(C(C(C(O6)CO)O)O)O
Standard InChIKey NVUHVENKCFNJQW-GDPYHQKMSA-N
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.
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.
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.

Source of 3Beta-Isodihydrocadambine 4-oxide

The barks of Picrasma quassioides

Protocol of 3Beta-Isodihydrocadambine 4-oxide

Structure Identification
Helvetica Chimica Acta, 2008, 91(11):2148-2152.

Indole Alkaloids from the Leaves of Anthocephalus chinensis.[Reference: WebLink]


METHODS AND RESULTS:
Anthocephalusine A (1) and 3Beta-Isodihydrocadambine 4-oxide(2) were isolated from the leaves of Anthocephalus chinensis (Rubiaceae), together with five known compounds. The structures were established by spectroscopic methods including 2D‐NMR analyses.

3Beta-Isodihydrocadambine 4-oxide Dilution Calculator

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3Beta-Isodihydrocadambine 4-oxide Molarity Calculator

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Preparing Stock Solutions of 3Beta-Isodihydrocadambine 4-oxide

1 mg 5 mg 10 mg 20 mg 25 mg
1 mM 1.7775 mL 8.8873 mL 17.7746 mL 35.5492 mL 44.4365 mL
5 mM 0.3555 mL 1.7775 mL 3.5549 mL 7.1098 mL 8.8873 mL
10 mM 0.1777 mL 0.8887 mL 1.7775 mL 3.5549 mL 4.4437 mL
50 mM 0.0355 mL 0.1777 mL 0.3555 mL 0.711 mL 0.8887 mL
100 mM 0.0178 mL 0.0889 mL 0.1777 mL 0.3555 mL 0.4444 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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References on 3Beta-Isodihydrocadambine 4-oxide

2,2'-Sulfonyl-dipyrazine 4-oxide.[Pubmed:22798929]

Acta Crystallogr Sect E Struct Rep Online. 2012 Jul 1;68(Pt 7):o2285.

In the title compound, C(8)H(6)N(4)O(3)S, the dihedral angle between the pyrazine rings is 85.04 (1) degrees . In the crystal, mol-ecules are arranged along the a axis and are linked by C-Hcdots, three dots, centeredN hydrogen bonds and pyrazine-pyrazine pi-pi inter-actions [centroid-centroid distance = 3.800 (1) A, forming an infinite chain array. The chains are connected by C-Hcdots, three dots, centeredO(oxide) hydrogen bonds into layers lying parallel to the ab plane. Along the c axis, the layers are stacked and linked through C-Hcdots, three dots, centeredO(sulfon-yl) inter-actions, forming a three-dimensional network.

3-Methyl-quinoxaline-2-carb-oxy-lic acid 4-oxide monohydrate.[Pubmed:21588010]

Acta Crystallogr Sect E Struct Rep Online. 2010 Jun 26;66(Pt 7):o1801.

In the crystal structure of the title compound, C(10)H(8)N(2)O(3).H(2)O, mol-ecules are linked via inter-molecular O-Hcdots, three dots, centeredO and O-Hcdots, three dots, centeredN hydrogen bonds into a two-dimensional network.

La0.3Sr0.2Mn0.1Zn0.4 oxide-Sm0.2Ce0.8O1.9 (LSMZ-SDC) nanocomposite cathode for low temperature SOFCs.[Pubmed:22905565]

J Nanosci Nanotechnol. 2012 Jun;12(6):4994-7.

Nanocomposite based cathode materials compatible for low temperature solid oxide fuel cells (LTSOFCs) are being developed. In pursuit of compatible cathode, this research aims to synthesis and investigation nanocomposite La0.3Sr0.2Mn0.1Zn0.4 oxide-Sm0.2Ce0.8O1.9 (LSMZ-SDC) based system. The material was synthesized through wet chemical method and investigated for oxide-ceria composite based electrolyte LTSOFCs. Electrical property was studied by AC electrochemical impedance spectroscopy (EIS). The microstructure, thermal properties, and elemental analysis of the samples were characterized by TGA/DSC, XRD, SEM, respectively. The AC conductivity of cathode was obtained for 2.4 Scm(-1) at 550 degrees C in air. This cathode is compatible with ceria-based composite electrolytes and has improved the stability of the material in SOFC cathode environment.

Vibrational spectroscopy investigation using ab initio and DFT vibrational analysis of 7-chloro-2-methylamino-5-phenyl-3H-1,4-benzodiazepine-4-oxide.[Pubmed:23732619]

Spectrochim Acta A Mol Biomol Spectrosc. 2013 Sep;113:224-35.

The FT-IR and FT-Raman spectrum of 7-chloro-2-methylamino-5-phenyl-3H-1, 4-benzodiazepine-4-oxide (7CMP4BO) has been recorded in the region 4000-400 and 4000-100 cm(-1) respectively. The optimized geometry, Thermodynamic properties, NBO, Molecular Electrostatic Potentials, PES, frequency and intensity of the vibrational bands of 7CMP4BO were obtained by the ab initio HF and density functional theory (DFT), B3LYP/6-31G (d,p) basis set. The molecule orbital contributions were studied by using the total (TDOS), partial (PDOS), and overlap population (OPDOS) density of states. The harmonic vibrational frequencies were calculated and the scaled values have been compared with experimental FT-IR and FT-Raman spectra. A detailed interpretation of the vibrational spectra of this compound has been made on the basis of the calculated potential energy distribution (PED). The linear polarizability (alpha) and the first order hyperpolarizability (beta) values of the investigated molecule have been computed using DFT quantum mechanical calculations. The observed and the calculated frequencies are found to be in good agreement. The experimental spectra also coincide satisfactorily with those of theoretically calculated values.

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