557-59-5 Purity
99%+
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Specification
The PubChem CID of Anisodamine is 6918612.
The molecular formula of Anisodamine is C17H23NO4.
The molecular weight of Anisodamine is 305.4 g/mol.
The synonyms of Anisodamine include anisodamine, 55869-99-3, Hyoscyamine, 6-hydroxy-, Anisodamine, (+/-)-, and Raceanisodamine.
The IUPAC name of Anisodamine is [(1R,3S,5R,6S)-6-hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] (2S)-3-hydroxy-2-phenylpropanoate.
The InChI of Anisodamine is InChI=1S/C17H23NO4/c1-18-12-7-13(9-15(18)16(20)8-12)22-17(21)14(10-19)11-5-3-2-4-6-11/h2-6,12-16,19-20H,7-10H2,1H3/t12-,13-,14+,15+,16-/m0/s1
The InChIKey of Anisodamine is WTQYWNWRJNXDEG-RBZJEDDUSA-N.
The canonical SMILES of Anisodamine is CN1C2CC(CC1C(C2)O)OC(=O)C(CO)C3=CC=CC=C3.
The CAS number of Anisodamine is 55869-99-3.
The XLogP3 of Anisodamine is 0.9.