Kaempferol 3-neohesperidoside-7-(6''-malonylglucoside)

Properties Image Occurences in reactions MNX_ID MNXM58780 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C37H44O24 charge 0 mass 872.22225 reference lipidmapsM:LMPK12111964 InChIKey GFYBKTBIGUBCIT-ZVFSZLMISA-N InChI InChI=1S/C37H44O24/c1-12-23(44)27(48)30(51)35(55-12)61-34-29(50)24(45)18(9-38)58-37(34)60-33-26(47)22-16(40)6-15(7-17(22)57-32(33)13-2-4-14(39)5-3-13)56-36-31(52)28(49)25(46)19(59-36)10-53-11-54-21(43)8-20(41)42/h2-7,12,18-19,23-25,27-31,34-40,44-46,48-52H,8-11H2,1H3,(H,41,42)/t12?,18?,19?,23-,24+,25+,27?,28-,29-,30-,31?,34?,35-,36+,37-/m0/s1 SMILES CC1O[C@@H](OC2[C@H](Oc3c(-c4ccc(O)cc4)oc4cc(O[C@@H]5OC(COCOC(=O)CC(=O)O)[C@@H](O)[C@H](O)C5O)cc(O)c4c3=O)OC(CO)[C@@H](O)[C@@H]2O)[C@@H](O)C(O)[C@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph