octanedioate

Properties Image MNX_ID MNXM12964 reference chebi:76282 formula C8H12O4 global charge -2 mol weight 172.18 InChIKey TYFQFVWCELRYAO-UHFFFAOYSA-L InChI InChI=1S/C8H14O4/c9-7(10)5-3-1-2-4-6-8(11)12/h1-6H2,(H,9,10)(H,11,12)/p-2 SMILES O=C([O-])CCCCCCC(=O)[O-] MNX internals InChI (mnx) InChI=1/C8H14O4/c9-7(10)5-3-1-2-4-6-8(11)12/h1-6H2,(H,9,10)(H,11,12) SMILES (mnx) [CH2:1]([CH2:2][CH2:4][CH2:6][C:8](=[O:11])[OH:12])[CH2:3][CH2:5][C:7](=[O:9])[OH:10]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 4 in models (compartimentalized) 6