1,4,5-trihydroxy-6,7,8-trimethoxy-2-methylanthraquinone

Properties Image MNX_ID MNXM32328 reference metacycM:CPD-9633 formula C18H16O8 global charge 0 mol weight 360.318 InChIKey MEHFFTKCQDPUMR-UHFFFAOYSA-N InChI InChI=1S/C18H16O8/c1-6-5-7(19)8-9(12(6)20)14(22)11-10(13(8)21)15(23)17(25-3)18(26-4)16(11)24-2/h5,19-20,23H,1-4H3 SMILES COC1=C(O)C2=C(C(=O)C3=C(C2=O)C(O)=CC(C)=C3O)C(OC)=C1OC MNX internals InChI (mnx) InChI=1/C18H16O8/c1-6-5-7(19)8-9(12(6)20)14(22)11-10(13(8)21)15(23)17(25-3)18(26-4)16(11)24-2/h5,19-20,23H,1-4H3 SMILES (mnx) [CH3:1][C:6]1=[CH:5][C:7]([OH:19])=[C:8]2[C:9](=[C:12]1[OH:20])[C:14](=[O:22])[C:11]1=[C:10]([C:13]2=[O:21])[C:15]([OH:23])=[C:17]([O:25][CH3:3])[C:18]([O:26][CH3:4])=[C:16]1[O:24][CH3:2]

Parent-child relations graph

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