Gentisuric acid

Properties Image MNX_ID MNXM156286 reference chebi:88742 formula C9H9NO5 global charge 0 mol weight 211.173 InChIKey FBFATOOJCPDQOZ-UHFFFAOYSA-N InChI InChI=1S/C9H9NO5/c11-5-1-2-7(12)6(3-5)9(15)10-4-8(13)14/h1-3,11-12H,4H2,(H,10,15)(H,13,14) SMILES O=C(O)CNC(=O)C1=C(O)C=CC(O)=C1 MNX internals InChI (mnx) InChI=1/C9H9NO5/c11-5-1-2-7(12)6(3-5)9(15)10-4-8(13)14/h1-3,11-12H,4H2,(H,10,15)(H,13,14) SMILES (mnx) [CH:1]1=[CH:2][C:7]([OH:12])=[C:6]([C:9](=[N:10][CH2:4][C:8](=[O:13])[OH:14])[OH:15])[CH:3]=[C:5]1[OH:11]

Parent-child relations graph

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