Licoriphenone

Properties Image MNX_ID MNXM127331 reference chebi:175788 formula C21H24O6 global charge 0 mol weight 372.417 InChIKey LXLBPEZCZLGOGJ-UHFFFAOYSA-N InChI InChI=1S/C21H24O6/c1-12(2)5-7-15-20(26-3)11-19(25)16(21(15)27-4)10-18(24)14-8-6-13(22)9-17(14)23/h5-6,8-9,11,22-23,25H,7,10H2,1-4H3 SMILES COC1=CC(O)=C(CC(=O)C2=C(O)C=C(O)C=C2)C(OC)=C1CC=C(C)C MNX internals InChI (mnx) InChI=1/C21H24O6/c1-12(2)5-7-15-20(26-3)11-19(25)16(21(15)27-4)10-18(24)14-8-6-13(22)9-17(14)23/h5-6,8-9,11,22-23,25H,7,10H2,1-4H3 SMILES (mnx) [CH3:1][C:12]([CH3:2])=[CH:5][CH2:7][C:15]1=[C:20]([O:26][CH3:3])[CH:11]=[C:19]([OH:25])[C:16]([CH2:10][C:18]([C:14]2=[C:17]([OH:23])[CH:9]=[C:13]([OH:22])[CH:6]=[CH:8]2)=[O:24])=[C:21]1[O:27][CH3:4]

Parent-child relations graph

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