Molecule ID: 129626647

IUPAC Name: 1-hydroxy-2-[(E)-non-1-enyl]quinolin-4-one

Description: The molecule is a hydroxylamine that is N-hydroxyquinolin-4-one in which the hydrogen at position 2 has been replaced by a (1E)-non-1-en-1-yl group. It is the most active agent produced by Pseudomonas aeruginosa that modulates the growth and virulence of Staphylococcus aureus; the corresponding Z isomer is inactive. It has a role as a bacterial metabolite and an antibacterial agent. It is a member of hydroxylamines, a quinolone, an organic heterobicyclic compound and an olefinic compound.

SMILES: CCCCCCC/C=C/c1cc(=O)c2ccccc2n1O

SELFIES: [C][C][C][C][C][C][C][/C][=C][/C][=C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][O][O]

InChI: InChI=1S/C18H23NO2/c1-2-3-4-5-6-7-8-11-15-14-18(20)16-12-9-10-13-17(16)19(15)21/h8-14,21H,2-7H2,1H3/b11-8+

Molecular Properties:
- Polar Surface Area: 40.5 Ų
- LogP: 5.4