Basic information
- CAS
6415-90-3- Standard SMILES
Br.CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2- InChIKey
VZDNSFSBCMCXSK-UHFFFAOYSA-N- Molecular formula
- C17H24BrNO3
- Average molar mass
- 370.3 g/mol
- Monoisotopic mass
- 369.09396
Names & identifiers
- Preferred name
- 8-Methyl-8-azabicyclo(3.2.1)octan-3-yl 3-hydroxy-2-phenylpropanoate--hydrogen bromide (1/1)
- IUPAC
- (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 3-hydroxy-2-phenylpropanoate;hydrobromide
- English name
- atropine hydrobromide
- Molecular formula
- C17H24BrNO3
- Molecular weight
- 370.28136
Names & synonyms
DTXSID609826518-Methyl-8-azabicyclo(3.2.1)octan-3-yl 3-hydroxy-2-phenylpropanoate--hydrogen bromide (1/1)8-Methyl-8-azabicyclo[3.2.1]octan-3-yl 3-hydroxy-2-phenylpropanoate--hydrogen bromide (1/1)RefChem:1074755DTXCID301409911HYOSCYAMINE HBrDaturine (hydrobromide)L-Hyoscyamine (hydrobromide)(8-Methyl-8-azabicyclo[3.2.1]octan-3-yl) (2S)-3-hydroxy-2-phenylpropanoate;hydrobromideHyoscyaminhydrobromidSCHEMBL5025985(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 3-hydroxy-2-phenylpropanoate;hydrobromide
Show more names
atropine hydrobromide
Database identifiers
- CAS
6415-90-3- PubChem CID
- 20733
- DTXSID
DTXSID60982651
Properties
Computed structural properties
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 353
Physicochemical properties
- FDA UNII
- 6 VKW7R97ZU · 6VKW7R97ZU
Chemistry & industry
Applications
UsesAtropine (Tropine tropate) hydrobromide is a competitive muscarinic acetylcholine receptor (mAChR) antagonist with IC50 values of 0.39 and 0.71 nM for Human mAChR M4 and Chicken mAChR M4, respectively. Atropine hydrobromide inhibits ACh-induced relaxations in human pulmonary veins. Atropine hydrobromide can be used for research of anti-myopia and bradycardia[1][2][3][4].
Suppliers4 total
Alfa Chemistry+1-5166625404 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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