xanthomicrol

Properties Image MNX_ID MNXM89154 reference chebi:35047 formula C18H16O7 global charge 0 mol weight 344.319 InChIKey SAMBWAJRKKEEOR-UHFFFAOYSA-N InChI InChI=1S/C18H16O7/c1-22-16-14(21)13-11(20)8-12(9-4-6-10(19)7-5-9)25-15(13)17(23-2)18(16)24-3/h4-8,19,21H,1-3H3 SMILES COC1=C(O)C2=C(OC(C3=CC=C(O)C=C3)=CC2=O)C(OC)=C1OC MNX internals InChI (mnx) InChI=1/C18H16O7/c1-22-16-14(21)13-11(20)8-12(9-4-6-10(19)7-5-9)25-15(13)17(23-2)18(16)24-3/h4-8,19,21H,1-3H3 SMILES (mnx) [CH3:1][O:22][C:16]1=[C:18]([O:24][CH3:3])[C:17]([O:23][CH3:2])=[C:15]2[C:13](=[C:14]1[OH:21])[C:11](=[O:20])[CH:8]=[C:12]([C:9]1=[CH:5][CH:7]=[C:10]([OH:19])[CH:6]=[CH:4]1)[O:25]2

Parent-child relations graph

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