5-Methoxyseselin

Properties Image MNX_ID MNXM118261 reference chebi:174378 formula C15H14O4 global charge 0 mol weight 258.273 InChIKey ZNMRQYJUVCXNGK-UHFFFAOYSA-N InChI InChI=1S/C15H14O4/c1-15(2)7-6-10-12(19-15)8-11(17-3)9-4-5-13(16)18-14(9)10/h4-8H,1-3H3 SMILES COC1=CC2=C(C=CC(C)(C)O2)C2=C1C=CC(=O)O2 MNX internals InChI (mnx) InChI=1/C15H14O4/c1-15(2)7-6-10-12(19-15)8-11(17-3)9-4-5-13(16)18-14(9)10/h4-8H,1-3H3 SMILES (mnx) [CH3:1][C:15]1([CH3:2])[CH:7]=[CH:6][C:10]2=[C:14]3[C:9](=[C:11]([O:17][CH3:3])[CH:8]=[C:12]2[O:19]1)[CH:4]=[CH:5][C:13](=[O:16])[O:18]3

Parent-child relations graph

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