compound 0262251

Properties Image MNX_ID MNXM1185006 reference envipathM:...d3601d955dd6 formula C12H17O8 global charge -1 mol weight 289.26 InChIKey OKUQPMXDVYHRHD-UHFFFAOYSA-M InChI InChI=1S/C12H18O8/c1-5(13)12(8(15)3-9(16)17)20-10-4-7(14)11(18)6(2)19-10/h6-7,10-12,14,18H,3-4H2,1-2H3,(H,16,17)/p-1 SMILES CC(=O)C(OC1CC(O)C(O)C(C)O1)C(=O)CC(=O)[O-] MNX internals InChI (mnx) InChI=1/C12H18O8/c1-5(13)12(8(15)3-9(16)17)20-10-4-7(14)11(18)6(2)19-10/h6-7,10-12,14,18H,3-4H2,1-2H3,(H,16,17)/t6?,7?,10?,11?,12? SMILES (mnx) [CH3:1][C:5]([CH:12]([C:8]([CH2:3][C:9](=[O:16])[OH:17])=[O:15])[O:20][CH:10]1[CH2:4][CH:7]([OH:14])[CH:11]([OH:18])[CH:6]([CH3:2])[O:19]1)=[O:13]

Parent-child relations graph

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