Achimilic acid

Properties Image MNX_ID MNXM118792 reference chebi:174657 formula C15H18O5 global charge 0 mol weight 278.304 InChIKey ARZDSTJTDVJYCF-XYOKQWHBSA-N InChI InChI=1S/C15H18O5/c1-9(16)4-5-11(10(2)14(18)19)8-12-13(17)6-7-15(12,3)20/h6-8,11,20H,2,4-5H2,1,3H3,(H,18,19)/b12-8+ SMILES C=C(C(=O)O)C(/C=C1\C(=O)C=CC1(C)O)CCC(C)=O MNX internals InChI (mnx) InChI=1/C15H18O5/c1-9(16)4-5-11(10(2)14(18)19)8-12-13(17)6-7-15(12,3)20/h6-8,11,20H,2,4-5H2,1,3H3,(H,18,19)/b12-8+/t11?,15? SMILES (mnx) [CH3:1][C:9]([CH2:4][CH2:5][CH:11](/[CH:8]=[C:12]1\[C:13](=[O:17])[CH:6]=[CH:7][C:15]1([CH3:3])[OH:20])[C:10](=[CH2:2])[C:14](=[O:18])[OH:19])=[O:16]

Parent-child relations graph

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