Avenanthramide A2

Properties Image MNX_ID MNXM119548 reference chebi:191662 formula C18H19NO7 global charge 0 mol weight 361.35 InChIKey PESXZYVWZYEQPY-GQCTYLIASA-N InChI InChI=1S/C18H19NO7/c1-25-15-7-10(3-5-13(15)20)4-6-17(22)19-12-9-16(26-2)14(21)8-11(12)18(23)24/h3-9,18,20-21,23-24H,1-2H3,(H,19,22)/b6-4+ SMILES COC1=CC(NC(=O)/C=C/C2=CC(OC)=C(O)C=C2)=C(C(O)O)C=C1O MNX internals InChI (mnx) InChI=1/C18H19NO7/c1-25-15-7-10(3-5-13(15)20)4-6-17(22)19-12-9-16(26-2)14(21)8-11(12)18(23)24/h3-9,18,20-21,23-24H,1-2H3,(H,19,22)/b6-4+ SMILES (mnx) [CH3:1][O:25][C:15]1=[C:13]([OH:20])[CH:5]=[CH:3][C:10](/[CH:4]=[CH:6]/[C:17](=[N:19]/[C:12]2=[CH:9][C:16]([O:26][CH3:2])=[C:14]([OH:21])[CH:8]=[C:11]2[CH:18]([OH:23])[OH:24])[OH:22])=[CH:7]1

Parent-child relations graph

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