5-pyridoxate

Properties Image MNX_ID MNXM3190 reference chebi:30960 formula C8H8NO4 global charge -1 mol weight 182.155 InChIKey VJZTVPVXKYQRJZ-UHFFFAOYSA-M InChI InChI=1S/C8H9NO4/c1-4-7(11)6(3-10)5(2-9-4)8(12)13/h2,10-11H,3H2,1H3,(H,12,13)/p-1 SMILES CC1=NC=C(C(=O)[O-])C(CO)=C1O MNX internals InChI (mnx) InChI=1/C8H9NO4/c1-4-7(11)6(3-10)5(2-9-4)8(12)13/h2,10-11H,3H2,1H3,(H,12,13) SMILES (mnx) [CH3:1][C:4]1=[N:9][CH:2]=[C:5]([C:8](=[O:12])[OH:13])[C:6]([CH2:3][OH:10])=[C:7]1[OH:11]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 4 in models (compartimentalized) 0