(3R,12betaS)-3,7,8-trihydroxy-3-methyl-4,12beta-dihydro-2H-tetraphene-1,6-dione

Properties Image MNX_ID MNXM31067 reference seedM:cpd23658 formula C19H16O5 global charge 0 mol weight 324.332 InChIKey UKSDTFDZVMWGDQ-LJQANCHMSA-N InChI InChI=1S/C19H16O5/c1-19(24)7-10-6-13(21)17-11(15(10)14(22)8-19)5-9-3-2-4-12(20)16(9)18(17)23/h2-6,20-21,23-24H,7-8H2,1H3/t19-/m1/s1 SMILES C[C@]1(O)CC(=O)C2=C(C=C(O)C3=C(O)C4=C(O)C=CC=C4C=C23)C1 MNX internals InChI (mnx) InChI=1/C19H16O5/c1-19(24)7-10-6-13(21)17-11(15(10)14(22)8-19)5-9-3-2-4-12(20)16(9)18(17)23/h2-6,20-21,23-24H,7-8H2,1H3/t19-/m1/s1 SMILES (mnx) [CH3:1][C@@:19]1([OH:24])[CH2:7][C:10]2=[CH:6][C:13]([OH:21])=[C:17]3[C:11](=[C:15]2[C:14](=[O:22])[CH2:8]1)[CH:5]=[C:9]1[CH:3]=[CH:2][CH:4]=[C:12]([OH:20])[C:16]1=[C:18]3[OH:23]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0