compound 0053766

Properties Image MNX_ID MNXM1139110 reference envipathM:...29cbac9b7005 formula C18H22O6 global charge 0 mol weight 334.368 InChIKey ANZQTDVFUJMDBW-UHFFFAOYSA-N InChI InChI=1S/C18H22O6/c1-17(2,11-6-5-7-13(19)8-11)23-24-18(3,4)12-9-14(20)16(22)15(21)10-12/h5-10,19-22H,1-4H3 SMILES CC(C)(OOC(C)(C)C1=CC(O)=C(O)C(O)=C1)C1=CC=CC(O)=C1 MNX internals InChI (mnx) InChI=1/C18H22O6/c1-17(2,11-6-5-7-13(19)8-11)23-24-18(3,4)12-9-14(20)16(22)15(21)10-12/h5-10,19-22H,1-4H3 SMILES (mnx) [CH3:1][C:17]([CH3:2])([C:11]1=[CH:8][C:13]([OH:19])=[CH:7][CH:5]=[CH:6]1)[O:23][O:24][C:18]([CH3:3])([CH3:4])[C:12]1=[CH:9][C:14]([OH:20])=[C:16]([OH:22])[C:15]([OH:21])=[CH:10]1

Parent-child relations graph

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