compound 0069539

Properties Image MNX_ID MNXM1192293 reference envipathM:...075225ee7fac formula C15H19O7 global charge -3 mol weight 311.31 InChIKey AZBAHWBJSJSQLA-QNRZBPGKSA-K InChI InChI=1S/C15H22O7/c1-9(12(16)17)8-11(10(2)13(18)19)22-7-5-6-15(3,4)14(20)21/h8H,5-7H2,1-4H3,(H,16,17)(H,18,19)(H,20,21)/p-3/b9-8-,11-10+ SMILES C/C(=C/C(OCCCC(C)(C)C(=O)[O-])=C(/C)C(=O)[O-])C(=O)[O-] MNX internals InChI (mnx) InChI=1/C15H22O7/c1-9(12(16)17)8-11(10(2)13(18)19)22-7-5-6-15(3,4)14(20)21/h8H,5-7H2,1-4H3,(H,16,17)(H,18,19)(H,20,21)/b9-8-,11-10+ SMILES (mnx) [CH3:1]/[C:9](=[CH:8]/[C:11](=[C:10](/[CH3:2])[C:13](=[O:18])[OH:19])[O:22][CH2:7][CH2:5][CH2:6][C:15]([CH3:3])([CH3:4])[C:14](=[O:20])[OH:21])[C:12](=[O:16])[OH:17]

Parent-child relations graph

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