8-O-methylsterigmatocystin

Properties Image MNX_ID MNXM3522 reference chebi:18171 formula C19H14O6 global charge 0 mol weight 338.315 InChIKey JKUJKKGMOZDDJV-ZRNGKTOUSA-N InChI InChI=1S/C19H14O6/c1-21-10-4-3-5-11-15(10)17(20)16-12(22-2)8-13-14(18(16)24-11)9-6-7-23-19(9)25-13/h3-9,19H,1-2H3/t9-,19+/m0/s1 SMILES COC1=C2C(=O)C3=C(OC)C=C4O[C@H]5OC=C[C@H]5C4=C3OC2=CC=C1 MNX internals InChI (mnx) InChI=1/C19H14O6/c1-21-10-4-3-5-11-15(10)17(20)16-12(22-2)8-13-14(18(16)24-11)9-6-7-23-19(9)25-13/h3-9,19H,1-2H3/t9-,19+/m0/s1 SMILES (mnx) [CH3:1][O:21][C:10]1=[C:15]2[C:11](=[CH:5][CH:3]=[CH:4]1)[O:24][C:18]1=[C:14]3[C@@H:9]4[CH:6]=[CH:7][O:23][C@@H:19]4[O:25][C:13]3=[CH:8][C:12]([O:22][CH3:2])=[C:16]1[C:17]2=[O:20]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 8 in models (compartimentalized) 0