7,4'-Dihydroxy-3'-methoxy-8-methylflavan

Properties Image MNX_ID MNXM39029 reference lipidmapsM:LMPK12020240 formula C17H18O4 global charge 0 mol weight 286.327 InChIKey ATVCDSNHSGVQSG-HNNXBMFYSA-N InChI InChI=1S/C17H18O4/c1-10-13(18)6-3-11-5-8-15(21-17(10)11)12-4-7-14(19)16(9-12)20-2/h3-4,6-7,9,15,18-19H,5,8H2,1-2H3/t15-/m0/s1 SMILES COC1=C(O)C=CC([C@@H]2CCC3=C(O2)C(C)=C(O)C=C3)=C1 MNX internals InChI (mnx) InChI=1/C17H18O4/c1-10-13(18)6-3-11-5-8-15(21-17(10)11)12-4-7-14(19)16(9-12)20-2/h3-4,6-7,9,15,18-19H,5,8H2,1-2H3/t15-/m0/s1 SMILES (mnx) [CH3:1][C:10]1=[C:13]([OH:18])[CH:6]=[CH:3][C:11]2=[C:17]1[O:21][C@H:15]([C:12]1=[CH:9][C:16]([O:20][CH3:2])=[C:14]([OH:19])[CH:7]=[CH:4]1)[CH2:8][CH2:5]2

Parent-child relations graph

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