HIT ID: HIT214319063
Cas No: 6415-90-3
分子式: C17H24BrNO3
分子量: 370.287
常用名: Atropine hydrobromide
氢键受体数 (HBA): 3
氢键供体数 (HBD): 1
LogP: 1.76
IUPAC: (1R,3R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl 3-hydroxy-2-phenylpropanoate hydrobromide
IUPAC: (1R,3R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl 3-hydroxy-2-phenylpropanoate hydrobromide
SMILES: Br.[H][C@]12CC[C@]([H])(C[C@@H](C1)OC(=O)C(CO)c1ccccc1)N2C |TLB:10:8:22:3.4|
SMILES: Br.[H][C@]12CC[C@]([H])(C[C@@H](C1)OC(=O)C(CO)c1ccccc1)N2C |TLB:10:8:22:3.4|
InChI key: VZDNSFSBCMCXSK-RIMUKSHESA-N