6-O-Methyleuparin

Properties Image MNX_ID MNXM38915 reference chebi:2222 formula C14H14O3 global charge 0 mol weight 230.263 InChIKey XFSSPJGVPRWHLS-UHFFFAOYSA-N InChI InChI=1S/C14H14O3/c1-8(2)12-6-10-5-11(9(3)15)14(16-4)7-13(10)17-12/h5-7H,1H2,2-4H3 SMILES C=C(C)C1=CC2=CC(C(C)=O)=C(OC)C=C2O1 MNX internals InChI (mnx) InChI=1/C14H14O3/c1-8(2)12-6-10-5-11(9(3)15)14(16-4)7-13(10)17-12/h5-7H,1H2,2-4H3 SMILES (mnx) [CH2:1]=[C:8]([CH3:2])[C:12]1=[CH:6][C:10]2=[CH:5][C:11]([C:9]([CH3:3])=[O:15])=[C:14]([O:16][CH3:4])[CH:7]=[C:13]2[O:17]1

Parent-child relations graph

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