Asterric acid

Properties Image MNX_ID MNXM97927 reference chebi:201421 formula C17H16O8 global charge 0 mol weight 348.307 InChIKey XOKVHFNTYHPEHN-UHFFFAOYSA-N InChI InChI=1S/C17H16O8/c1-8-4-11(19)14(16(20)21)12(5-8)25-15-10(17(22)24-3)6-9(18)7-13(15)23-2/h4-7,18-19H,1-3H3,(H,20,21) SMILES COC(=O)C1=C(OC2=C(C(=O)O)C(O)=CC(C)=C2)C(OC)=CC(O)=C1 MNX internals InChI (mnx) InChI=1/C17H16O8/c1-8-4-11(19)14(16(20)21)12(5-8)25-15-10(17(22)24-3)6-9(18)7-13(15)23-2/h4-7,18-19H,1-3H3,(H,20,21) SMILES (mnx) [CH3:1][C:8]1=[CH:4][C:11]([OH:19])=[C:14]([C:16](=[O:20])[OH:21])[C:12]([O:25][C:15]2=[C:10]([C:17](=[O:22])[O:24][CH3:3])[CH:6]=[C:9]([OH:18])[CH:7]=[C:13]2[O:23][CH3:2])=[CH:5]1

Parent-child relations graph

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