compound 0099679

Properties Image MNX_ID MNXM1185631 reference envipathM:...a29092300fe4 formula C14H19O6 global charge -1 mol weight 283.3 InChIKey QLPMJXBQERTGCM-UHFFFAOYSA-M InChI InChI=1S/C14H20O6/c1-7(11(16)13(18)19)9-4-8(6-15)5-10(12(9)17)14(2,3)20/h4-5,7,11,15-17,20H,6H2,1-3H3,(H,18,19)/p-1 SMILES CC(C1=CC(CO)=CC(C(C)(C)O)=C1O)C(O)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C14H20O6/c1-7(11(16)13(18)19)9-4-8(6-15)5-10(12(9)17)14(2,3)20/h4-5,7,11,15-17,20H,6H2,1-3H3,(H,18,19)/t7?,11? SMILES (mnx) [CH3:1][CH:7]([C:9]1=[C:12]([OH:17])[C:10]([C:14]([CH3:2])([CH3:3])[OH:20])=[CH:5][C:8]([CH2:6][OH:15])=[CH:4]1)[CH:11]([C:13](=[O:18])[OH:19])[OH:16]

Parent-child relations graph

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