4-Methyl-epicatechin

Properties Image MNX_ID MNXM117989 reference chebi:174912 formula C16H16O6 global charge 0 mol weight 304.298 InChIKey NLCHNUHNZBPKDF-WLZLGPGOSA-N InChI InChI=1S/C16H16O6/c1-7-14-12(20)5-9(17)6-13(14)22-16(15(7)21)8-2-3-10(18)11(19)4-8/h2-7,15-21H,1H3/t7?,15-,16-/m1/s1 SMILES CC1C2=C(C=C(O)C=C2O)O[C@H](C2=CC(O)=C(O)C=C2)[C@@H]1O MNX internals InChI (mnx) InChI=1/C16H16O6/c1-7-14-12(20)5-9(17)6-13(14)22-16(15(7)21)8-2-3-10(18)11(19)4-8/h2-7,15-21H,1H3/t7?,15-,16-/m1/s1 SMILES (mnx) [CH3:1][CH:7]1[C:14]2=[C:12]([OH:20])[CH:5]=[C:9]([OH:17])[CH:6]=[C:13]2[O:22][C@H:16]([C:8]2=[CH:4][C:11]([OH:19])=[C:10]([OH:18])[CH:3]=[CH:2]2)[C@@H:15]1[OH:21]

Parent-child relations graph

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