compound 0216511

Properties Image MNX_ID MNXM1172921 reference envipathM:...e0a67920ab28 formula C10H13O5 global charge -1 mol weight 213.209 InChIKey KOUUQKXUENTQMZ-ONEGZZNKSA-M InChI InChI=1S/C10H14O5/c1-6(2)3-4-7(11)8(12)5-9(13)10(14)15/h3-4,6,9,13H,5H2,1-2H3,(H,14,15)/p-1/b4-3+ SMILES CC(C)/C=C/C(=O)C(=O)CC(O)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C10H14O5/c1-6(2)3-4-7(11)8(12)5-9(13)10(14)15/h3-4,6,9,13H,5H2,1-2H3,(H,14,15)/b4-3+/t9? SMILES (mnx) [CH3:1][CH:6]([CH3:2])/[CH:3]=[CH:4]/[C:7]([C:8]([CH2:5][CH:9]([C:10](=[O:14])[OH:15])[OH:13])=[O:12])=[O:11]

Parent-child relations graph

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