compound 0050505

Properties Image MNX_ID MNXM1250175 reference envipathM:...e9c9c844ac36 formula C6H7O3 global charge -1 mol weight 127.119 InChIKey SAMCJYXDHVQPTB-UHFFFAOYSA-M InChI InChI=1S/C6H8O3/c1-4(2)3-5(7)6(8)9/h1,3H2,2H3,(H,8,9)/p-1 SMILES C=C(C)CC(=O)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C6H8O3/c1-4(2)3-5(7)6(8)9/h1,3H2,2H3,(H,8,9) SMILES (mnx) [CH2:1]=[C:4]([CH3:2])[CH2:3][C:5]([C:6]([OH:8])=[O:9])=[O:7]

Parent-child relations graph

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