Aspecioside

Properties Image Occurences in reactions MNX_ID MNXM42828 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C29H42O10 charge 0 mass 550.2778 reference chebi:2878 InChIKey BEDAFJYDKDOALK-FHLCUQDTSA-N InChI InChI=1S/C29H42O10/c1-13-22(32)23(33)24(34)25(37-13)38-16-4-6-26(2)15(9-16)10-20-29(39-20)18(26)11-19(30)27(3)17(5-7-28(27,29)35)14-8-21(31)36-12-14/h8,13,15-20,22-25,30,32-35H,4-7,9-12H2,1-3H3/t13-,15-,16+,17-,18-,19-,20+,22-,23-,24-,25+,26+,27+,28-,29-/m1/s1 SMILES C[C@H]1O[C@@H](O[C@H]2CC[C@@]3(C)[C@H](C2)C[C@@H]2O[C@]24[C@@H]3C[C@@H](O)[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@@]24O)[C@H](O)[C@H](O)[C@@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph