Lyconnotine

AlkaPlorer ID: AK014038

Synonym: '', 'Lyconnotine'

IUPAC Name: methyl 3-[(8R,9S,13S)-8-hydroxy-1-azatricyclo[7.3.1.05,13]trideca-3,5-dien-13-yl]-2-methylpropanoate

Structure

SMILES: COC(=O)C(C)C[C@@]12C3=CC[C@@H](O)[C@H]1CCCN2CC=C3

copy

InChI: InChI=1S/C17H25NO3/c1-12(16(20)21-2)11-17-13-5-3-9-18(17)10-4-6-14(17)15(19)8-7-13/h3,5,7,12,14-15,19H,4,6,8-11H2,1-2H3/t12?,14-,15-,17-/m1/s1

copy

InChIKey: YHPKLMGYAYSJRU-UYPCIZBGSA-N

copy

Source

Properties Information

Molecule Weight: 291.391

TPSA: 49.77

MolLogP: 1.8972

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