Pelargonidin 5-O-beta-D-glucoside 3-O-beta-D-sambubioside

Properties Image Occurences in reactions MNX_ID MNXM28826 #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0 formula C32H39O19 charge 1 mass 727.20801 reference keggC:C20492 InChIKey NNEATHLRLZWIRN-MRBLLYQQSA-O InChI InChI=1S/C32H38O19/c33-8-19-22(39)24(41)27(44)31(49-19)47-17-6-13(36)5-16-14(17)7-18(28(46-16)11-1-3-12(35)4-2-11)48-32-29(25(42)23(40)20(9-34)50-32)51-30-26(43)21(38)15(37)10-45-30/h1-7,15,19-27,29-34,37-44H,8-10H2,(H-,35,36)/p+1/t15-,19-,20-,21+,22-,23-,24+,25+,26-,27-,29-,30+,31-,32-/m1/s1 SMILES OC[C@H]1O[C@@H](Oc2cc(O)cc3[o+]c(-c4ccc(O)cc4)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4OC[C@@H](O)[C@H](O)[C@H]4O)cc23)[C@H](O)[C@@H](O)[C@@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph