hyperxanthone E

Properties Image MNX_ID MNXM105665 reference chebi:66058 formula C18H16O6 global charge 0 mol weight 328.32 InChIKey JXBWMJZDYVJVIV-UHFFFAOYSA-N InChI InChI=1S/C18H16O6/c1-18(2)4-3-9-14-13(7-11(21)17(9)24-18)23-12-6-8(19)5-10(20)15(12)16(14)22/h5-7,19-21H,3-4H2,1-2H3 SMILES CC1(C)CCC2=C(O1)C(O)=CC1=C2C(=O)C2=C(O)C=C(O)C=C2O1 MNX internals InChI (mnx) InChI=1/C18H16O6/c1-18(2)4-3-9-14-13(7-11(21)17(9)24-18)23-12-6-8(19)5-10(20)15(12)16(14)22/h5-7,19-21H,3-4H2,1-2H3 SMILES (mnx) [CH3:1][C:18]1([CH3:2])[CH2:4][CH2:3][C:9]2=[C:14]3[C:13](=[CH:7][C:11]([OH:21])=[C:17]2[O:24]1)[O:23][C:12]1=[CH:6][C:8]([OH:19])=[CH:5][C:10]([OH:20])=[C:15]1[C:16]3=[O:22]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0