5,6-Dimethoxysterigmatocystin

Properties Image MNX_ID MNXM50956 reference chebi:168632 formula C20H16O8 global charge 0 mol weight 384.34 InChIKey RSPJLZQIZABVSE-UHFFFAOYSA-N InChI InChI=1S/C20H16O8/c1-23-10-7-11-13(8-4-5-26-20(8)27-11)18-15(10)16(22)14-9(21)6-12(24-2)17(25-3)19(14)28-18/h4-8,20-21H,1-3H3 SMILES COC1=CC2=C(C3=C1C(=O)C1=C(O3)C(OC)=C(OC)C=C1O)C1C=COC1O2 MNX internals InChI (mnx) InChI=1/C20H16O8/c1-23-10-7-11-13(8-4-5-26-20(8)27-11)18-15(10)16(22)14-9(21)6-12(24-2)17(25-3)19(14)28-18/h4-8,20-21H,1-3H3/t8?,20? SMILES (mnx) [CH3:1][O:23][C:10]1=[C:15]2[C:16](=[O:22])[C:14]3=[C:19]([C:17]([O:25][CH3:3])=[C:12]([O:24][CH3:2])[CH:6]=[C:9]3[OH:21])[O:28][C:18]2=[C:13]2[CH:8]3[CH:4]=[CH:5][O:26][CH:20]3[O:27][C:11]2=[CH:7]1

Parent-child relations graph

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