asperuloside

Properties Image Occurences in reactions MNX_ID MNXM10750 #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0 formula C18H22O11 charge 0 mass 414.11621 reference chebi:2881 InChIKey IBIPGYWNOBGEMH-DILZHRMZSA-N InChI InChI=1S/C18H22O11/c1-6(20)25-4-7-2-9-12-8(16(24)27-9)5-26-17(11(7)12)29-18-15(23)14(22)13(21)10(3-19)28-18/h2,5,9-15,17-19,21-23H,3-4H2,1H3/t9-,10+,11+,12-,13+,14-,15+,17-,18-/m0/s1 SMILES CC(=O)OCC1=C[C@@H]2OC(=O)C3=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H]1[C@@H]32

Parent-child relations graph

Deprecated MNXref IDs graph