1,6,8-trihydroxy-7-methoxy-2-methylanthraquinone

Properties Image MNX_ID MNXM32386 reference metacycM:CPD-9627 formula C16H12O6 global charge 0 mol weight 300.266 InChIKey HCRUWIGJIZVCAW-UHFFFAOYSA-N InChI InChI=1S/C16H12O6/c1-6-3-4-7-10(12(6)18)14(20)11-8(13(7)19)5-9(17)16(22-2)15(11)21/h3-5,17-18,21H,1-2H3 SMILES COC1=C(O)C2=C(C=C1O)C(=O)C1=C(C2=O)C(O)=C(C)C=C1 MNX internals InChI (mnx) InChI=1/C16H12O6/c1-6-3-4-7-10(12(6)18)14(20)11-8(13(7)19)5-9(17)16(22-2)15(11)21/h3-5,17-18,21H,1-2H3 SMILES (mnx) [CH3:1][C:6]1=[C:12]([OH:18])[C:10]2=[C:7]([CH:4]=[CH:3]1)[C:13](=[O:19])[C:8]1=[CH:5][C:9]([OH:17])=[C:16]([O:22][CH3:2])[C:15]([OH:21])=[C:11]1[C:14]2=[O:20]

Parent-child relations graph

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