(-)-dehydrodiconiferyl aldehyde

Properties Image MNX_ID MNXM147623 reference metacycM:CPD-17076 formula C20H20O6 global charge 0 mol weight 356.374 InChIKey GWCSSLSMGCFIFR-GWKPYITFSA-N InChI InChI=1S/C20H20O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h3-10,15,19,22-23H,11H2,1-2H3/b4-3+/t15-,19+/m1/s1 SMILES COC1=CC([C@@H]2OC3=C(C=C(/C=C/C=O)C=C3OC)[C@H]2CO)=CC=C1O MNX internals InChI (mnx) InChI=1/C20H20O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h3-10,15,19,22-23H,11H2,1-2H3/b4-3+/t15-,19+/m1/s1 SMILES (mnx) [CH3:1][O:24][C:17]1=[C:16]([OH:23])[CH:6]=[CH:5][C:13]([C@H:19]2[C@H:15]([CH2:11][OH:22])[C:14]3=[C:20]([C:18]([O:25][CH3:2])=[CH:9][C:12](/[CH:4]=[CH:3]/[CH:7]=[O:21])=[CH:8]3)[O:26]2)=[CH:10]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0