Cyaniden 3-rutinoside-5,3'-diglucoside

Properties Image Occurences in reactions MNX_ID MNXM22851 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C39H51O25 charge 1 mass 919.27139 reference lipidmapsM:LMPK12010130 InChIKey YQJZOOPKXKKTGM-CCVGIRBFSA-O InChI InChI=1S/C39H50O25/c1-11-23(44)27(48)31(52)36(57-11)56-10-22-26(47)30(51)34(55)39(64-22)61-19-7-14-16(5-13(42)6-17(14)59-37-32(53)28(49)24(45)20(8-40)62-37)58-35(19)12-2-3-15(43)18(4-12)60-38-33(54)29(50)25(46)21(9-41)63-38/h2-7,11,20-34,36-41,44-55H,8-10H2,1H3,(H-,42,43)/p+1/t11?,20?,21?,22?,23-,24+,25+,26+,27-,28-,29-,30?,31?,32?,33?,34?,36+,37+,38+,39+/m0/s1 SMILES CC1O[C@@H](OCC2O[C@@H](Oc3cc4c(O[C@@H]5OC(CO)[C@@H](O)[C@H](O)C5O)cc(O)cc4[o+]c3-c3ccc(O)c(O[C@@H]4OC(CO)[C@@H](O)[C@H](O)C4O)c3)C(O)C(O)[C@@H]2O)C(O)[C@@H](O)[C@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph