compound 0285829

Properties Image MNX_ID MNXM1181157 reference envipathM:...71c81fbce538 formula C10H8O7 global charge -2 mol weight 240.167 InChIKey YJEFMEGYFXQSCO-QPJJXVBHSA-L InChI InChI=1S/C10H10O7/c11-5-3-1-2-4(7(12)9(14)15)6(5)8(13)10(16)17/h1-2,5-6,11-12H,3H2,(H,14,15)(H,16,17)/p-2/b7-4+ SMILES O=C([O-])C(=O)C1/C(=C(/O)C(=O)[O-])C=CCC1O MNX internals InChI (mnx) InChI=1/C10H10O7/c11-5-3-1-2-4(7(12)9(14)15)6(5)8(13)10(16)17/h1-2,5-6,11-12H,3H2,(H,14,15)(H,16,17)/b7-4+/t5?,6? SMILES (mnx) [CH:1]1=[CH:2]/[C:4](=[C:7](/[C:9](=[O:14])[OH:15])[OH:12])[CH:6]([C:8]([C:10]([OH:16])=[O:17])=[O:13])[CH:5]([OH:11])[CH2:3]1

Parent-child relations graph

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