3,5-dimethylorsellinate

Properties Image MNX_ID MNXM147761 reference chebi:131856 formula C10H11O4 global charge -1 mol weight 195.194 InChIKey NZGSNQJCTOMELT-UHFFFAOYSA-M InChI InChI=1S/C10H12O4/c1-4-5(2)8(11)6(3)9(12)7(4)10(13)14/h11-12H,1-3H3,(H,13,14)/p-1 SMILES CC1=C(O)C(C)=C(O)C(C(=O)[O-])=C1C MNX internals InChI (mnx) InChI=1/C10H12O4/c1-4-5(2)8(11)6(3)9(12)7(4)10(13)14/h11-12H,1-3H3,(H,13,14) SMILES (mnx) [CH3:1][C:4]1=[C:5]([CH3:2])[C:8]([OH:11])=[C:6]([CH3:3])[C:9]([OH:12])=[C:7]1[C:10](=[O:13])[OH:14]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 5 in models (compartimentalized) 2