Pleurospermine; Me ether

AlkaPlorer ID: AK310725

Synonym: 3,4-Dimethoxy-ω-(2-piperidyl)acetophenone

IUPAC Name: 1-(3,4-dimethoxyphenyl)-2-piperidin-2-ylethanone

Structure

SMILES: COC1=CC=C(C(=O)CC2CCCCN2)C=C1OC

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InChI: InChI=1S/C15H21NO3/c1-18-14-7-6-11(9-15(14)19-2)13(17)10-12-5-3-4-8-16-12/h6-7,9,12,16H,3-5,8,10H2,1-2H3

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InChIKey: FWLXNNACYKINRF-UHFFFAOYSA-N

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Reference

PubChem CID: 79539385

COCONUT: CNP0169134.1

Properties Information

Molecule Weight: 263.337

TPSA: 47.56

MolLogP: 2.4187000000000003

Number of H-Donors: 1

Number of H-Acceptors: 4

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information