CAS Number8067-24-1
SynonymsDecril; circanol; Sponsin; Dihydroergotoxine mesylate; Dacoren; Trigot; Inorter; Lavendustin A; cck179; Dulcion; Perenan; Epos
Molecular FormulaC123H156N20O23S
Molecular Weight2314.74
Purity98.00%
Density1.34g/cm3
Boiling Point899.5ºC at 760 mmHg
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 8067-24-1 |
| Catalog No. | 2A-9034347 |
| Chinese Name | 甲磺酸双氢麦角碱 |
| Synonyms | Decril; circanol; Sponsin; Dihydroergotoxine mesylate; Dacoren; Trigot; Inorter; Lavendustin A; cck179; Dulcion; Perenan; Epos |
| Molecular Formula | C123H156N20O23S |
| Molecular Weight | 2314.74 |
| Purity | 98.00 |
| Density | 1.34g/cm3 |
| Boiling Point | 899.5ºC at 760 mmHg |
| Storage Condition | Store at RT |
| Packaging | III |
| Application | Dihydroergotoxine mesylate is a series of alkaloid salt mixtures with high binding activity to GABAA receptors. |
| PubChem ID | 17186159 |
| SMILES | CN1C[C@@H](CC2[C@H]1Cc3c[nH]c4cccc2c34)C(=O)N[C@]5(C)O[C@@]6(O)[C@@H]7CCCN7C(=O)[C@H](Cc8ccccc8)N6C5=O.C[S](O)(=O)=O |
| InChI | InChI=1S/C33H37N5O5.CH4O3S/c1-32(35-29(39)21-15-23-22-10-6-11-24-28(22)20(17-34-24)16-25(23)36(2)18-21)31(41)38-26(14-19-8-4-3-5-9-19)30(40)37-13-7-12-27(37)33(38,42)43-32;1-5(2,3)4/h3-6,8-11,17,21,23,25-27,34,42H,7,12-16,18H2,1-2H3,(H,35,39);1H3,(H,2,3,4)/t21-,23?,25-,26+,27+,32-,33+;/m1./s1 |
| InChI Key | InChIKey=ADYPXRFPBQGGAH-WVVAGBSPSA-N |
| Hazard Symbols | 6.1(b) |
| Bioactivity | Dihydroergotoxine mesylate is a complex of closely related alkaloid salts; Binds with high affinity to the GABAA receptor Cl- channel, producing an allosteric interaction with the benzodiazepine site.IC50 value:Target: Dihydroergotoxine mesylate also interacts with central dopaminergic, serotonergic and adrenergic (α1) receptors. Dihydroergotoxine mesylate displays antiproliferative activity in vitro (IC50 = 18 - 38 μM in prostate cancer cells) and exhibits cognition-enhancing, anticonvulsant and sedative activity in vivo. Related Catalog Signaling Pathways >> Membrane Transporter/Ion Channel >> GABA Receptor Signaling Pathways >> Neuronal Signaling >> GABA Receptor Research Areas >> Neurological Disease References [1]. Tvrdeic A, et al. Dihydrogenated ergot compounds bind with high affinity to GABAA receptor-associated Cl- ionophore. Eur J Pharmacol. 1991 Sep 4;202(1):109-11. [2]. Tvrdeic A, et al. Dihydroergotoxine modulation of the GABAA receptor-associated Cl- ionophore in mouse brain. Eur J Pharmacol. 1992 Oct 6;221(1):139-43. [3]. Tvrdeic A, et al. Effect of ergot alkaloids on 3H-flunitrazepam binding to mouse brain GABAA receptors. Coll Antropol. 2003;27 Suppl 1:175-82. [4]. Abdul M, et al. Expression of gamma-aminobutyric acid receptor (subtype A) in prostate cancer. Acta Oncol. 2008;47(8):1546-50. Chemical & Physical Properties Density 1.34g/cm3 Boiling Point 899.5ºC at 760 mmHg Molecular Formula C123H156N20O23S Molecular Weight 2314.74 Flash Point 497.8ºC PSA 131.11000 LogP 2.53850 Index of Refraction 1.66 Storage condition Store at RT |
| Use of | Dihydroergotoxine mesylate is a complex of closely related alkaloid salts; Binds with high affinity to the GABAA receptor Cl- channel, producing an allosteric interaction with the benzodiazepine site.IC50 value:Target: Dihydroergotoxine mesylate also interacts with central dopaminergic, serotonergic and adrenergic (α1) receptors. Dihydroergotoxine mesylate displays antiproliferative activity in vitro (IC50 = 18 - 38 μM in prostate cancer cells) and exhibits cognition-enhancing, anticonvulsant and sedative activity in vivo. Properties Articles25 Name ergoloid mesylate Synonym More Synonyms Dihydroergotoxine mesylate Biological Activity Description Dihydroergotoxine mesylate is a complex of closely related alkaloid salts; Binds with high affinity to the GABAA receptor Cl- channel, producing an allosteric interaction with the benzodiazepine site.IC50 value:Target: Dihydroergotoxine mesylate also interacts with central dopaminergic, serotonergic and adrenergic (α1) receptors. Dihydroergotoxine mesylate displays antiproliferative activity in vitro (IC50 = 18 - 38 μM in prostate cancer cells) and exhibits cognition-enhancing, anticonvulsant and sedative activity in vivo. Related Catalog Signaling Pathways >> Membrane Transporter/Ion Channel >> GABA Receptor Signaling Pathways >> Neuronal Signaling >> GABA Receptor Research Areas >> Neurological Disease References [1]. Tvrdeic A, et al. Dihydrogenated ergot compounds bind with high affinity to GABAA receptor-associated Cl- ionophore. Eur J Pharmacol. 1991 Sep 4;202(1):109-11. [2]. Tvrdeic A, et al. Dihydroergotoxine modulation of the GABAA receptor-associated Cl- ionophore in mouse brain. Eur J Pharmacol. 1992 Oct 6;221(1):139-43. [3]. Tvrdeic A, et al. Effect of ergot alkaloids on 3H-flunitrazepam binding to mouse brain GABAA receptors. Coll Antropol. 2003;27 Suppl 1:175-82. [4]. Abdul M, et al. Expression of gamma-aminobutyric acid receptor (subtype A) in prostate cancer. Acta Oncol. 2008;47(8):1546-50. Chemical & Physical Properties Molecular Formula C123H156N20O23S PSA 131.11000 LogP 2.53850 Index of Refraction 1.66 Storage condition Store at RT |
| Transport Info | Product name: Dihydroergotoxin mesylate |
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