Apoatropine

AlkaPlorer ID: AK018887

Synonym: '', 'Atropyltropeine hydrochloride', 'Atropamine hydrochloride', 'Apoatropine'

IUPAC Name: [(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] 2-phenylprop-2-enoate

Structure

SMILES: C=C(C(=O)O[C@@H]1C[C@H]2CC[C@@H](C1)N2C)C1=CC=CC=C1

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InChI: InChI=1S/C17H21NO2/c1-12(13-6-4-3-5-7-13)17(19)20-16-10-14-8-9-15(11-16)18(14)2/h3-7,14-16H,1,8-11H2,2H3/t14-,15+,16-

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InChIKey: WPUIZWXOSDVQJU-MUJYYYPQSA-N

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Properties Information

Molecule Weight: 271.36

TPSA: 29.54

MolLogP: 2.8682000000000016

Number of H-Donors: 0

Number of H-Acceptors: 3

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information