compound 0286885

Properties Image MNX_ID MNXM1138100 reference envipathM:...a280c1ce29b7 formula C12H18O4 global charge 0 mol weight 226.272 InChIKey MFWCVSKUJBKAEG-UHFFFAOYSA-N InChI InChI=1S/C12H18O4/c1-8-9(5-3-2-4-6-13)12(16)11(15)7-10(8)14/h7,13-16H,2-6H2,1H3 SMILES CC1=C(O)C=C(O)C(O)=C1CCCCCO MNX internals InChI (mnx) InChI=1/C12H18O4/c1-8-9(5-3-2-4-6-13)12(16)11(15)7-10(8)14/h7,13-16H,2-6H2,1H3 SMILES (mnx) [CH3:1][C:8]1=[C:9]([CH2:5][CH2:3][CH2:2][CH2:4][CH2:6][OH:13])[C:12]([OH:16])=[C:11]([OH:15])[CH:7]=[C:10]1[OH:14]

Parent-child relations graph

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