N-feruloyl tyramine-4-O-beta-D-glucopyranoside

Properties Image MNX_ID MNXM1132378 reference metacycM:CPD-23481 formula C24H29NO9 global charge 0 mol weight 475.494 InChIKey VVTVHDZQFUALQV-WNENLGFLSA-N InChI InChI=1S/C24H29NO9/c1-32-18-12-15(4-8-17(18)27)5-9-20(28)25-11-10-14-2-6-16(7-3-14)33-24-23(31)22(30)21(29)19(13-26)34-24/h2-9,12,19,21-24,26-27,29-31H,10-11,13H2,1H3,(H,25,28)/b9-5+/t19-,21-,22+,23-,24-/m1/s1 SMILES COC1=C(O)C=CC(/C=C/C(=O)NCCC2=CC=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C=C2)=C1 MNX internals InChI (mnx) InChI=1/C24H29NO9/c1-32-18-12-15(4-8-17(18)27)5-9-20(28)25-11-10-14-2-6-16(7-3-14)33-24-23(31)22(30)21(29)19(13-26)34-24/h2-9,12,19,21-24,26-27,29-31H,10-11,13H2,1H3,(H,25,28)/b9-5+/t19-,21-,22+,23-,24-/m1/s1 SMILES (mnx) [CH3:1][O:32][C:18]1=[C:17]([OH:27])[CH:8]=[CH:4][C:15](/[CH:5]=[CH:9]/[C:20](=[N:25]/[CH2:11][CH2:10][C:14]2=[CH:3][CH:7]=[C:16]([O:33][C@H:24]3[C@H:23]([OH:31])[C@@H:22]([OH:30])[C@H:21]([OH:29])[C@@H:19]([CH2:13][OH:26])[O:34]3)[CH:6]=[CH:2]2)[OH:28])=[CH:12]1

Parent-child relations graph

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