N-trans-feruloyl-4'-O-methyldopamine

Properties Image MNX_ID MNXM107148 reference chebi:67378 formula C19H21NO5 global charge 0 mol weight 343.379 InChIKey ACSWAJLDOHJFNA-VMPITWQZSA-N InChI InChI=1S/C19H21NO5/c1-24-17-7-4-14(11-16(17)22)9-10-20-19(23)8-5-13-3-6-15(21)18(12-13)25-2/h3-8,11-12,21-22H,9-10H2,1-2H3,(H,20,23)/b8-5+ SMILES COC1=CC(/C=C/C(=O)NCCC2=CC(O)=C(OC)C=C2)=CC=C1O MNX internals InChI (mnx) InChI=1/C19H21NO5/c1-24-17-7-4-14(11-16(17)22)9-10-20-19(23)8-5-13-3-6-15(21)18(12-13)25-2/h3-8,11-12,21-22H,9-10H2,1-2H3,(H,20,23)/b8-5+ SMILES (mnx) [CH3:1][O:24][C:17]1=[C:16]([OH:22])[CH:11]=[C:14]([CH2:9][CH2:10]/[N:20]=[C:19](/[CH:8]=[CH:5]/[C:13]2=[CH:12][C:18]([O:25][CH3:2])=[C:15]([OH:21])[CH:6]=[CH:3]2)[OH:23])[CH:4]=[CH:7]1

Parent-child relations graph

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