Hyoscyamine hydrobromideProduct ingredient for Hyoscyamine
- Name
- Hyoscyamine hydrobromide
- Drug Entry
- Hyoscyamine
Hyoscyamine is a tropane alkaloid and the levo-isomer of atropine.2 It is commonly extracted from plants in the Solanaceae or nightshade family.2 Research into the action of hyoscyamine in published literature dates back to 1826.6 Hyoscyamine is used for a wide variety of treatments and therapeutics due to its antimuscarinic properties.7,8
Although hyoscyamine is marketed in the United States, it is not FDA approved.7,8
- Accession Number
- DBSALT001048
- Structure
Structure for Hyoscyamine hydrobromide (DBSALT001048)
- Synonyms
- Not Available
- UNII
- IWT50P9S79
- CAS Number
- 306-03-6
- Weight
- Average: 370.287
Monoisotopic: 369.093957 - Chemical Formula
- C17H24BrNO3
- InChI Key
- VZDNSFSBCMCXSK-PGQIENJJSA-N
- InChI
- InChI=1S/C17H23NO3.BrH/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;1H/t13-,14+,15+,16-;/m1./s1
- IUPAC Name
- (1R,3S,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl (2S)-3-hydroxy-2-phenylpropanoate hydrobromide
- SMILES
- Br.CN1[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)[C@H](CO)C1=CC=CC=C1
- External Links
- ChemSpider
- 16498797
- ChEMBL
- CHEMBL2106364
- Predicted Properties
Property Value Source Water Solubility 2.52 mg/mL ALOGPS logP 2.19 ALOGPS logP 1.57 Chemaxon logS -2.1 ALOGPS pKa (Strongest Acidic) 15.15 Chemaxon pKa (Strongest Basic) 9.39 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 3 Chemaxon Hydrogen Donor Count 1 Chemaxon Polar Surface Area 49.77 Å2 Chemaxon Rotatable Bond Count 5 Chemaxon Refractivity 80.82 m3·mol-1 Chemaxon Polarizability 31.4 Å3 Chemaxon Number of Rings 3 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon