Molecule ID: 440899

IUPAC Name: 5-hydroxy-4-(hydroxymethyl)-6-methylpyridine-3-carbaldehyde

Description: The molecule is a pyridinecarbaldehyde that is pyridine-5-carbaldehyde bearing methyl, hydroxy and hydroxymethyl substituents at positions 2, 3 and 4 respectively. It has a role as a metabolite. It is a hydroxymethylpyridine, a monohydroxypyridine, a member of methylpyridines and a pyridinecarbaldehyde.

SMILES: Cc1ncc(C=O)c(CO)c1O

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

InChI: InChI=1S/C8H9NO3/c1-5-8(12)7(4-11)6(3-10)2-9-5/h2-3,11-12H,4H2,1H3

Molecular Properties:
- Polar Surface Area: 70.4 Ų
- LogP: 0.0