Delphinidin 3-(2-xylosylgalactoside)-5-(6-acetylglucoside)

Properties Image Occurences in reactions MNX_ID MNXM27013 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C34H41O22 charge 1 mass 801.2084 reference lipidmapsM:LMPK12010274 InChIKey BPKSCEYQFADAOR-SZDJCHFRSA-O InChI InChI=1S/C34H40O22/c1-10(36)49-9-21-25(44)26(45)29(48)33(55-21)52-18-5-12(37)4-17-13(18)6-19(30(51-17)11-2-14(38)22(41)15(39)3-11)53-34-31(27(46)24(43)20(7-35)54-34)56-32-28(47)23(42)16(40)8-50-32/h2-6,16,20-21,23-29,31-35,40,42-48H,7-9H2,1H3,(H3-,37,38,39,41)/p+1/t16-,20?,21?,23+,24+,25-,26+,27+,28?,29?,31?,32+,33-,34-/m1/s1 SMILES CC(=O)OCC1O[C@@H](Oc2cc(O)cc3[o+]c(-c4cc(O)c(O)c(O)c4)c(O[C@@H]4OC(CO)[C@H](O)[C@H](O)C4O[C@@H]4OC[C@@H](O)[C@H](O)C4O)cc23)C(O)[C@@H](O)[C@@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph