MedKoo Cat#: 413845 | Name: Belladonnine

Description:

WARNING: This product is for research use only, not for human or veterinary use.

Belladonnine is a member of class of tropane alkaloids. Belladonnine can be found in plants of family Solanaceae. Commercially available preparations called "belladonnine" are sometimes a mixture of this chemical with atropine. β-Belladonnine selectively blocks heart M-receptors (ED50: 13 μg/kg): a blockage of smooth muscles and secretory organs M-cholinoreceptors requires a 10 to 20 times higher concentration. β-Belladonnine also blocks skeletal muscles N-cholinoreceptors (ED50: 50-60 mg/kg).

Chemical Structure

Belladonnine
Belladonnine
CAS#510-25-8

Theoretical Analysis

MedKoo Cat#: 413845

Name: Belladonnine

CAS#: 510-25-8

Chemical Formula: C34H42N2O4

Exact Mass: 542.3145

Molecular Weight: 542.72

Elemental Analysis: C, 75.25; H, 7.80; N, 5.16; O, 11.79

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.
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Related CAS #
No Data
Synonym
Belladonnine; Isatropylditropeine; Tropyl isatropate
IUPAC/Chemical Name
1,4-Naphthalenedicarboxylic acid, 1,2,3,4-tetrahydro-1-phenyl-, bis(8-methyl-8-azabicyclo(3.2.1)oct-3-yl) ester
InChi Key
GERIGMSHTUAXSI-UHFFFAOYSA-N
InChi Code
InChI=1S/C34H42N2O4/c1-35-23-12-13-24(35)19-27(18-23)39-32(37)30-16-17-34(22-8-4-3-5-9-22,31-11-7-6-10-29(30)31)33(38)40-28-20-25-14-15-26(21-28)36(25)2/h3-11,23-28,30H,12-21H2,1-2H3
SMILES Code
O=C(C1(C2=CC=CC=C2)CCC(C(OC3CC(N4C)CCC4C3)=O)C5=C1C=CC=C5)OC6CC(N7C)CCC7C6
Appearance
Solid powder
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
To be determined
Shelf Life
>2 years if stored properly
Drug Formulation
To be determined
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 542.72 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL
1: ROSENBLUM EI, TAYLOR WS. The detection of apoatropine and belladonnine in atropine. J Pharm Pharmacol. 1955 Dec;7(12):1067-71. doi: 10.1111/j.2042-7158.1955.tb12119.x. PMID: 13278854. 2: Maurya VK, Kumar S, Bhatt MLB, Saxena SK. Antiviral activity of traditional medicinal plants from Ayurveda against SARS-CoV-2 infection. J Biomol Struct Dyn. 2020 Oct 19:1-17. doi: 10.1080/07391102.2020.1832577. Epub ahead of print. PMID: 33073699; PMCID: PMC7597308. 3: HOTOVY R. Zur Pharmakologie des Belladonnins [Pharmacology of belladonnine]. Arzneimittelforschung. 1954 Apr;4(4):287-92. Undetermined Language. PMID: 13159731. 4: HOTOVY R, KAPFF-WALTER J, FIEBIG L. [Modification of the local analgesic action of local anesthetics by belladonnine sulfate]. Arch Int Pharmacodyn Ther. 1962 Sep 1;139:281-300. German. PMID: 13955008. 5: Arráez-Román D, Zurek G, Bässmann C, Segura-Carretero A, Fernández-Gutiérrez A. Characterization of Atropa belladonna L. compounds by capillary electrophoresis-electrospray ionization-time of flight-mass spectrometry and capillary electrophoresis-electrospray ionization-ion trap-mass spectrometry. Electrophoresis. 2008 May;29(10):2112-6. doi: 10.1002/elps.200700468. PMID: 18425749. 6: IMO K. Uber Belladonninbromäthylat (C 100), ein neues Muskelrelaxans [Belladonnine bromethylate (C100), a new muscle relaxant]. Anaesthesist. 1954 Jun;3(3):116-8. German. PMID: 13207708. 7: WAALER T, BJERKELUND E. DIE SPEKTROPHOTOMETRISCHE BESTIMMUNG VON APOATROPIN UND BELLADONNIN IN ATROPIN [THE SPECTROPHOTOMETRIC DETERMINATION OF APOATROPINE AND BELLADONNINE IN ATROPINE]. Pharm Acta Helv. 1964 Mar;39:150-4. German. PMID: 14241289.