Molecule ID: 3464811

IUPAC Name: 3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-1-ium-4-carbaldehyde

Description: The molecule is a pyridinium ion obtained by protonation of the ring nitrogen of pyridoxal. It is a conjugate acid of a pyridoxal.

SMILES: Cc1[nH+]cc(CO)c(C=O)c1O

SELFIES: [C][C][=NH1+1][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/h2,4,10,12H,3H2,1H3/p+1

Molecular Properties:
- Polar Surface Area: 71.7 Ų
- LogP: 0.2