compound 0230289

Properties Image MNX_ID MNXM1192628 reference envipathM:...ce1757425ba6 formula C10H13O5 global charge -1 mol weight 213.209 InChIKey RCWOVKQYTYYFMU-UHFFFAOYSA-M InChI InChI=1S/C10H14O5/c1-4-7(8(12)9(13)14)6(2)10(3,15)5-11/h4-7,15H,1H2,2-3H3,(H,13,14)/p-1 SMILES C=CC(C(=O)C(=O)[O-])C(C)C(C)(O)C=O MNX internals InChI (mnx) InChI=1/C10H14O5/c1-4-7(8(12)9(13)14)6(2)10(3,15)5-11/h4-7,15H,1H2,2-3H3,(H,13,14)/t6?,7?,10? SMILES (mnx) [CH2:1]=[CH:4][CH:7]([CH:6]([CH3:2])[C:10]([CH3:3])([CH:5]=[O:11])[OH:15])[C:8]([C:9]([OH:13])=[O:14])=[O:12]

Parent-child relations graph

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