Daturine Hydrobromide

Base Information

• Chemical Name: Daturine Hydrobromide
• CAS No.: 4607-53-8
• Deprecated CAS: 4607-53-8
• Molecular Formula: C17H24BrNO3
• Molecular Weight: 370.3
• European Community (EC) Number: 206-174-6
• UNII: IWT50P9S79
• DSSTox Substance ID: DTXSID50889342
• Wikidata: Q27280923
• NCI Thesaurus Code: C75277
• ChEMBL ID: CHEMBL2106364
• Mol file: 4607-53-8.mol

Synonyms:Anaspaz;Atropine Sulfate, 3(S)-endo-Isomer;Atropine, 3(S)-endo-Isomer;Cytospaz;Hyoscyamine;Hyoscyamine Hydrobromide;Hyoscyamine Hydrochloride;Hyoscyamine Sulfate;Hyoscyamine Sulfate Anhydrous

Chemical Property of Daturine Hydrobromide

Chemical Property:

• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 369.09396
• Heavy Atom Count: 22
• Complexity: 353

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CN1C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3.Br
• Isomeric SMILES: CN1[C@@H]2CC[C@H]1CC(C2)OC(=O)[C@H](CO)C3=CC=CC=C3.Br