Hyoscyamine structure, CAS 101-31-5

Hyoscyamine

CAS Number101-31-5

SynonymsCYSTOSPAZ; L-Hyoscyamine; 3a-Tropanyl S-(-)-Tropate; (3-endo)-8-Methyl-8-azabicyclo[3.2.1]oct-3-yl-(2S)-3-hydroxy-2-phenylpropanoat; scopolamine HCl; SCOPINE TROPATE; Levsin; (3-endo)-8-Methyl-8-azabicyclo[3.2.1]oct-3-yl (2S)-3-hydroxy-2-phenylpropanoate; (S)-(-)-hyoscyamine; SCOPINE TROPATE HYDROCHLORIDE; MFCD00067306; (S)-atropine; Hyoscyamine; (-)-Hycosamine; (-)-Hyoscyamine; EINECS 202-933-0; Daturine; chlorhydratedescopolamine; Egacene; (-)-atropine; er),hcl; [3(S)-endo]-a-(Hydroxymethyl)benzeneacetic Acid 8-Methyl-8-azabicyclo[3.2.1]oct-3-yl Ester; Peptard; ScopolamineSeries; L-Tropine tropate; (2S)-(1R,5S)-8-Methyl-8-azabicyclo[3.2.1]octan-3-yl 3-hydroxy-2-phenylpropanoate; 1aH,5aH-Tropan-3a-ol(-)-tropate (Ester)

Molecular FormulaC17H23O3N1

Molecular Weight289.37

Purity98.00%

Density1.2±0.1 g/cm3

Boiling Point429.8±45.0 °C at 760 mmHg

Melting Point108.5ºC

Flash Point

AppearanceWhite crystalline powder

EINECS

MSDSChineseEnglish

SymbolTransport

Signal WordWarning

Cat. No.: 2A-9010875 Purity: 98.00%
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Quality Control of [ 101-31-5 ] Purity: 98.00% SDS Specification MoL

Chemical & Physical Properties
CAS Number101-31-5
Catalog No.2A-9010875
Chinese Name天仙子胺
SynonymsCYSTOSPAZ; L-Hyoscyamine; 3a-Tropanyl S-(-)-Tropate; (3-endo)-8-Methyl-8-azabicyclo[3.2.1]oct-3-yl-(2S)-3-hydroxy-2-phenylpropanoat; scopolamine HCl; SCOPINE TROPATE; Levsin; (3-endo)-8-Methyl-8-azabicyclo[3.2.1]oct-3-yl (2S)-3-hydroxy-2-phenylpropanoate; (S)-(-)-hyoscyamine; SCOPINE TROPATE HYDROCHLORIDE; MFCD00067306; (S)-atropine; Hyoscyamine; (-)-Hycosamine; (-)-Hyoscyamine; EINECS 202-933-0; Daturine; chlorhydratedescopolamine; Egacene; (-)-atropine; er),hcl; [3(S)-endo]-a-(Hydroxymethyl)benzeneacetic Acid 8-Methyl-8-azabicyclo[3.2.1]oct-3-yl Ester; Peptard; ScopolamineSeries; L-Tropine tropate; (2S)-(1R,5S)-8-Methyl-8-azabicyclo[3.2.1]octan-3-yl 3-hydroxy-2-phenylpropanoate; 1aH,5aH-Tropan-3a-ol(-)-tropate (Ester)
Molecular FormulaC17H23O3N1
Molecular Weight289.37
Purity98.00
Density1.2±0.1 g/cm3
Boiling Point429.8±45.0 °C at 760 mmHg
Melting Point108.5ºC
AppearanceWhite crystalline powder
Storage Condition2-8°C
ApplicationL-Hyoscyamine is a tropane alkaloid, the left-rotating isomer of atropine.
HTC2933990090
MDL NumberMFCD27980528
SMILESCN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2
InChIInChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/t13-,14+,15+,16-/m1/s1
InChI KeyRKUNBYITZUJHSG-VFSICIBPSA-N
Hazard SymbolsTransport
MSDSmsds/10875_1_101_31_5.pdf
BioactivityL-Hyoscyamine is a chemical compound, a tropane alkaloid it is the levo-isomer to atropine.Target: mAChRHyoscyamine is a chemical compound, a tropane alkaloid it is the levo-isomer to atropine. It is a secondary metabolite of some plants, particularly henbane (Hyoscamus niger.)Hyoscyamine is used to provide symptomatic relief to various gastrointestinal disorders including spasms, peptic ulcers, irritable bowel syndrome, pancreatitis, colic and cystitis. It has also been used to relieve some heart problems, control some of the symptoms of Parkinson's disease, as well as for control of respiratory secretions in end of life care [1]. Related Catalog Signaling Pathways >> GPCR/G Protein >> mAChR Signaling Pathways >> Neuronal Signaling >> mAChR Natural Products >> Alkaloid Research Areas >> Neurological Disease References [1]. http://www.drugbank.ca/drugs/DB00424 Chemical & Physical Properties Density 1.2±0.1 g/cm3 Boiling Point 429.8±45.0 °C at 760 mmHg Melting Point 108.5ºC Molecular Formula C17H23NO3 Molecular Weight 289.369 Flash Point 213.7±28.7 °C Exact Mass 289.167786 PSA 49.77000 LogP 1.53 Vapour Pressure 0.0±1.1 mmHg at 25°C Index of Refraction 1.581 InChIKey RKUNBYITZUJHSG-VFSICIBPSA-N SMILES CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2 Storage condition 2-8°C
Use ofL-Hyoscyamine is a chemical compound, a tropane alkaloid it is the levo-isomer to atropine.Target: mAChRHyoscyamine is a chemical compound, a tropane alkaloid it is the levo-isomer to atropine. It is a secondary metabolite of some plants, particularly henbane (Hyoscamus niger.)Hyoscyamine is used to provide symptomatic relief to various gastrointestinal disorders including spasms, peptic ulcers, irritable bowel syndrome, pancreatitis, colic and cystitis. It has also been used to relieve some heart problems, control some of the symptoms of Parkinson's disease, as well as for control of respiratory secretions in end of life care [1]. Properties Articles26 Name (S)-atropine Synonym More Synonyms Hyoscyamine Biological Activity Description L-Hyoscyamine is a chemical compound, a tropane alkaloid it is the levo-isomer to atropine.Target: mAChRHyoscyamine is a chemical compound, a tropane alkaloid it is the levo-isomer to atropine. It is a secondary metabolite of some plants, particularly henbane (Hyoscamus niger.)Hyoscyamine is used to provide symptomatic relief to various gastrointestinal disorders including spasms, peptic ulcers, irritable bowel syndrome, pancreatitis, colic and cystitis. It has also been used to relieve some heart problems, control some of the symptoms of Parkinson's disease, as well as for control of respiratory secretions in end of life care [1]. Related Catalog Signaling Pathways >> GPCR/G Protein >> mAChR Signaling Pathways >> Neuronal Signaling >> mAChR Natural Products >> Alkaloid Research Areas >> Neurological Disease References [1]. http://www.drugbank.ca/drugs/DB00424 Chemical & Physical Properties Molecular Formula C17H23NO3 Exact Mass 289.167786 PSA 49.77000 Index of Refraction 1.581 InChIKey RKUNBYITZUJHSG-VFSICIBPSA-N
Tax Rebate13.0%
SupervisionNone. MFN tariff: 6.5%. Ordinary tariff: 20.0%
Transport InfoProduct name: Purity: 98.0%
MSDS Transport InfoModule 14. Shipping information 14.1 UN dangerous goods number European Dangerous Regulations for land transport: 2811 International Dangerous Regulations for sea transport: 2811 International Dangerous Regulations for air transport: 2811 14.2 Names specified by the United Nations (UN) European Land Transport Dangerous Regulations: TOXIC SOLID, ORGANIC, N.O.S. (hyoscyamine) IMDG Code: TOXIC SOLID, ORGANIC, N.O.S. (hyoscyamine) International air transport hazard regulations: Toxic solid, organic, n.o.s. (hyoscyamine) 14.3 Transport hazard categories European Land Transport Danger Regulations: 6.1 International Maritime Transport Danger Regulations: 6.1 International Air Transport Danger Regulations: 6.1 14.4 Package group European Dangerous Regulations for land transport: II International Dangerous Regulations for sea transport: II International Dangerous Regulations for air transport: II 14.5 Environmental hazards European Land Transport Dangerous Regulations: No International Maritime Transport Dangerous Regulations Maritime Pollutants: No International Air Transport Risk Regulations: No 14.6 Special reminder to users No data available
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