CAS Number620-61-1
SynonymsAtropina Solfato; UNII:03J5ZE7KA5; L-TROPINE TROPATE SULFATE; atropine sulphate; L-Hyoscyamine Hemisulfate; atropin sulfate; (3-endo)-8-Methyl-8-azabicyclo[3.2.1]oct-3-yl 3-hydroxy-2-phenylpropanoate sulfate hydrate (2:1:1); Atropine Sulfate Monohydrate; MFCD00078244; levsinsulfate; EINECS 210-644-6; Atropinsulfat; (3-endo)-8-Methyl-8-azabicyclo[3.2.1]oct-3-yl (2S)-3-hydroxy-2-phenylpropanoate sulfate (2:1); L-HYOSCYAMINE SULFATE; Hyoscyamine sulfate hydrate
Molecular FormulaC17H24NO5S0.5
Molecular Weight676.817
Purity98%
Melting Point205-206ºC
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 620-61-1 |
| Catalog No. | 2A-9010876 |
| Chinese Name | 硫酸天仙子胺水合物 |
| Synonyms | Atropina Solfato; UNII:03J5ZE7KA5; L-TROPINE TROPATE SULFATE; atropine sulphate; L-Hyoscyamine Hemisulfate; atropin sulfate; (3-endo)-8-Methyl-8-azabicyclo[3.2.1]oct-3-yl 3-hydroxy-2-phenylpropanoate sulfate hydrate (2:1:1); Atropine Sulfate Monohydrate; MFCD00078244; levsinsulfate; EINECS 210-644-6; Atropinsulfat; (3-endo)-8-Methyl-8-azabicyclo[3.2.1]oct-3-yl (2S)-3-hydroxy-2-phenylpropanoate sulfate (2:1); L-HYOSCYAMINE SULFATE; Hyoscyamine sulfate hydrate |
| Molecular Formula | C17H24NO5S0.5 |
| Molecular Weight | 676.817 |
| Purity | 98 |
| Melting Point | 205-206ºC |
| Storage Condition | 2-8°C, dry, sealed |
| Packaging | III |
| Application | L-Hyoscyamine sulfate (Daturine sulfate) is a tropane alkaloid and a secondary metabolite of some plants of the Solanaceae family. In vitro experiments indicate that it is an antagonist of mAChR recep |
| SMILES | CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2.CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2.O=S(=O)(O)O |
| InChI | InChI=1S/2C17H23NO3.H2O4S/c2*1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12;1-5(2,3)4/h2*2-6,13-16,19H,7-11H2,1H3;(H2,1,2,3,4)/t2*13?,14?,15?,16-;/m11./s1 |
| InChI Key | HOBWAPHTEJGALG-YMCAWCDYSA-N |
| Bioactivity | L-Hyoscyamine sulfate (Daturine sulfate) is a tropane alkaloid that is a secondary metabolite found in certain plants of the solanaceae family. In vitro it has been shown to be an antagonist of mAChR[1]. Related Catalog Signaling Pathways >> Neuronal Signaling >> mAChR Signaling Pathways >> GPCR/G Protein >> mAChR Research Areas >> Neurological Disease References [1]. Jones JB, et al. Sublingual hyoscyamine sulfate in combination with ketorolac tromethamine for ureteral colic: a randomized, double-blind, controlled trial. Ann Emerg Med. 2001 Feb;37(2):141-6. Chemical & Physical Properties Melting Point 205-206ºC Molecular Formula C17H24NO5S0.5 Molecular Weight 676.817 Exact Mass 676.302979 PSA 191.75000 LogP 4.10130 Index of Refraction -28 ° (C=5, H2O) InChIKey HOBWAPHTEJGALG-YMCAWCDYSA-N SMILES CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2.CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2.O=S(=O)(O)O |
| Use of | L-Hyoscyamine sulfate (Daturine sulfate) is a tropane alkaloid that is a secondary metabolite found in certain plants of the solanaceae family. In vitro it has been shown to be an antagonist of mAChR[1]. Properties Name l-hyoscyamine hemisulfate salt Synonym More Synonyms Hyoscyamine sulfate hydrate Biological Activity Description L-Hyoscyamine sulfate (Daturine sulfate) is a tropane alkaloid that is a secondary metabolite found in certain plants of the solanaceae family. In vitro it has been shown to be an antagonist of mAChR[1]. Related Catalog Signaling Pathways >> Neuronal Signaling >> mAChR Signaling Pathways >> GPCR/G Protein >> mAChR Research Areas >> Neurological Disease References [1]. Jones JB, et al. Sublingual hyoscyamine sulfate in combination with ketorolac tromethamine for ureteral colic: a randomized, double-blind, controlled trial. Ann Emerg Med. 2001 Feb;37(2):141-6. Chemical & Physical Properties Molecular Formula C17H24NO5S0.5 Exact Mass 676.302979 PSA 191.75000 LogP 4.10130 InChIKey HOBWAPHTEJGALG-YMCAWCDYSA-N |
| Transport Info | Product name: Purity: 98.0% |
| MSDS Transport Info | Module 14. Shipping information United Nations classification: Item 1 Poisons. UN number: 1544 Formal shipping name: Alkaloid, solid, not otherwise specified Packing grade: III |
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