Hydroxywighteone

Properties Image MNX_ID MNXM56957 reference lipidmapsM:LMPK12050195 formula C20H18O6 global charge 0 mol weight 354.358 InChIKey AROTXIUFXQZGLT-BIIKFXOESA-N InChI InChI=1S/C20H18O6/c1-11(9-21)2-7-14-16(23)8-17-18(19(14)24)20(25)15(10-26-17)12-3-5-13(22)6-4-12/h2-6,8,10,21-24H,7,9H2,1H3/b11-2+ SMILES C/C(=C\CC1=C(O)C=C2OC=C(C3=CC=C(O)C=C3)C(=O)C2=C1O)CO MNX internals InChI (mnx) InChI=1/C20H18O6/c1-11(9-21)2-7-14-16(23)8-17-18(19(14)24)20(25)15(10-26-17)12-3-5-13(22)6-4-12/h2-6,8,10,21-24H,7,9H2,1H3/b11-2+ SMILES (mnx) [CH3:1]/[C:11](=[CH:2]\[CH2:7][C:14]1=[C:19]([OH:24])[C:18]2=[C:17]([CH:8]=[C:16]1[OH:23])[O:26][CH:10]=[C:15]([C:12]1=[CH:4][CH:6]=[C:13]([OH:22])[CH:5]=[CH:3]1)[C:20]2=[O:25])[CH2:9][OH:21]

Parent-child relations graph

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