Apohyoscine

AlkaPlorer ID: AK422182

Synonym: None

IUPAC Name: [(2S,4R)-9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-7-yl] 2-phenylprop-2-enoate

Structure

SMILES: C=C(C(=O)OC1CC2[C@H]3O[C@H]3C(C1)N2C)C1=CC=CC=C1

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InChI: InChI=1S/C17H19NO3/c1-10(11-6-4-3-5-7-11)17(19)20-12-8-13-15-16(21-15)14(9-12)18(13)2/h3-7,12-16H,1,8-9H2,2H3/t12?,13?,14?,15-,16+

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InChIKey: JJNVDCBKBUSUII-SVFSVNPNSA-N

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Source

Properties Information

Molecule Weight: 285.343

TPSA: 42.07

MolLogP: 1.8554

Number of H-Donors: 0

Number of H-Acceptors: 4

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information