4-Hydroxyepilupinine; 11-O-Benzoyl 

AlkaPlorer ID: AK301094

Synonym: 11-O-Benzoyl-4-hydroxyepilupinine 

IUPAC Name: (2-hydroxy-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl)methyl benzoate

Structure

SMILES: O=C(OCC1C(O)CCN2CCCCC12)C1=CC=CC=C1

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InChI: InChI=1S/C17H23NO3/c19-16-9-11-18-10-5-4-8-15(18)14(16)12-21-17(20)13-6-2-1-3-7-13/h1-3,6-7,14-16,19H,4-5,8-12H2

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InChIKey: GPGRTALYVPJSHH-UHFFFAOYSA-N

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Reference

PubChem CID: 162996955

COCONUT: CNP0270397.1

Properties Information

Molecule Weight: 289.37499999999994

TPSA: 49.77

MolLogP: 2.0786999999999995

Number of H-Donors: 1

Number of H-Acceptors: 4

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information