Molecule ID: 135962791

IUPAC Name: (NE)-N-[(4-methoxy-6-phenylpyridin-2-yl)methylidene]hydroxylamine

Description: The molecule is a pyridine alkaloid that is 2-phenylpyridine substituted by a methoxy group at position 4 and a (E)-(hydroxyimino)methyl group at position 6. Isolated from the marine-derived actinomycete Actinoalloteichus cyanogriseus, it exhibits antineoplastic activity. It has a role as an antineoplastic agent, a bacterial metabolite and a marine metabolite. It is an aldoxime, an aromatic ether and a pyridine alkaloid.

SMILES: COc1cc(/C=N/O)nc(-c2ccccc2)c1

SELFIES: [C][O][C][=C][C][Branch1][Ring2][/C][=N][/O][=N][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][#C]

InChI: InChI=1S/C13H12N2O2/c1-17-12-7-11(9-14-16)15-13(8-12)10-5-3-2-4-6-10/h2-9,16H,1H3/b14-9+

Molecular Properties:
- Polar Surface Area: 54.7 Ų
- LogP: 2.5