Junipegenin B

Properties Image MNX_ID MNXM58569 reference lipidmapsM:LMPK12050406 formula C18H16O7 global charge 0 mol weight 344.319 InChIKey MZERYTHMEZCPQG-UHFFFAOYSA-N InChI InChI=1S/C18H16O7/c1-22-12-5-4-9(6-13(12)23-2)10-8-25-14-7-11(19)18(24-3)17(21)15(14)16(10)20/h4-8,19,21H,1-3H3 SMILES COC1=CC=C(C2=COC3=C(C2=O)C(O)=C(OC)C(O)=C3)C=C1OC MNX internals InChI (mnx) InChI=1/C18H16O7/c1-22-12-5-4-9(6-13(12)23-2)10-8-25-14-7-11(19)18(24-3)17(21)15(14)16(10)20/h4-8,19,21H,1-3H3 SMILES (mnx) [CH3:1][O:22][C:12]1=[C:13]([O:23][CH3:2])[CH:6]=[C:9]([C:10]2=[CH:8][O:25][C:14]3=[C:15]([C:16]2=[O:20])[C:17]([OH:21])=[C:18]([O:24][CH3:3])[C:11]([OH:19])=[CH:7]3)[CH:4]=[CH:5]1

Parent-child relations graph

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