Citflavanone

Properties Image MNX_ID MNXM47040 reference chebi:187683 formula C20H18O5 global charge 0 mol weight 338.359 InChIKey JTJIFFUHXHGAOQ-UHFFFAOYSA-N InChI InChI=1S/C20H18O5/c1-20(2)8-7-13-17(25-20)10-15(23)18-14(22)9-16(24-19(13)18)11-3-5-12(21)6-4-11/h3-8,10,16,21,23H,9H2,1-2H3 SMILES CC1(C)C=CC2=C3OC(C4=CC=C(O)C=C4)CC(=O)C3=C(O)C=C2O1 MNX internals InChI (mnx) InChI=1/C20H18O5/c1-20(2)8-7-13-17(25-20)10-15(23)18-14(22)9-16(24-19(13)18)11-3-5-12(21)6-4-11/h3-8,10,16,21,23H,9H2,1-2H3/t16? SMILES (mnx) [CH3:1][C:20]1([CH3:2])[CH:8]=[CH:7][C:13]2=[C:17]([CH:10]=[C:15]([OH:23])[C:18]3=[C:19]2[O:24][CH:16]([C:11]2=[CH:4][CH:6]=[C:12]([OH:21])[CH:5]=[CH:3]2)[CH2:9][C:14]3=[O:22])[O:25]1

Parent-child relations graph

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