rel-(7R,8R,7'R,8'R)-3,4,3',4'-dimethylene-dioxy-5,5'-dimethoxy-7,7'-epoxylignan

Properties Image MNX_ID MNXM108503 reference chebi:69323 formula C22H24O7 global charge 0 mol weight 400.427 InChIKey ISBKEYQPAWAMRF-IIBDXVJDSA-N InChI InChI=1S/C22H24O7/c1-11-12(2)20(14-6-16(24-4)22-18(8-14)26-10-28-22)29-19(11)13-5-15(23-3)21-17(7-13)25-9-27-21/h5-8,11-12,19-20H,9-10H2,1-4H3/t11-,12-,19-,20-/m1/s1 SMILES COC1=CC([C@@H]2O[C@@H](C3=CC4=C(OCO4)C(OC)=C3)[C@H](C)[C@H]2C)=CC2=C1OCO2 MNX internals InChI (mnx) InChI=1/C22H24O7/c1-11-12(2)20(14-6-16(24-4)22-18(8-14)26-10-28-22)29-19(11)13-5-15(23-3)21-17(7-13)25-9-27-21/h5-8,11-12,19-20H,9-10H2,1-4H3/t11-,12-,19-,20-/m1/s1 SMILES (mnx) [CH3:1][C@@H:11]1[C@@H:12]([CH3:2])[C@H:20]([C:14]2=[CH:6][C:16]([O:24][CH3:4])=[C:22]3[C:18](=[CH:8]2)[O:26][CH2:10][O:28]3)[O:29][C@H:19]1[C:13]1=[CH:5][C:15]([O:23][CH3:3])=[C:21]2[C:17](=[CH:7]1)[O:25][CH2:9][O:27]2

Parent-child relations graph

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