Cyanidin 3-O-[(6-O-malonyl-2-O-beta-D-xylopyranosyl)-beta-D-glucopyranoside]-7-O-beta-D-glucopyranoside

Properties Image Occurences in reactions MNX_ID MNXM24523 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C35H41O23 charge 1 mass 829.20331 reference lipidmapsM:LMPK12010212 InChIKey LIHFAKVUZYFNPM-NSNKDYDESA-O InChI InChI=1S/C35H40O23/c36-8-20-25(45)27(47)30(50)34(56-20)53-12-4-15(38)13-6-19(31(54-18(13)5-12)11-1-2-14(37)16(39)3-11)55-35-32(58-33-29(49)24(44)17(40)9-52-33)28(48)26(46)21(57-35)10-51-23(43)7-22(41)42/h1-6,17,20-21,24-30,32-36,40,44-50H,7-10H2,(H3-,37,38,39,41,42)/p+1/t17-,20?,21?,24?,25-,26-,27+,28+,29?,30?,32?,33+,34-,35-/m1/s1 SMILES O=C(O)CC(=O)OCC1O[C@@H](Oc2cc3c(O)cc(O[C@@H]4OC(CO)[C@@H](O)[C@H](O)C4O)cc3[o+]c2-c2ccc(O)c(O)c2)C(O[C@@H]2OC[C@@H](O)C(O)C2O)[C@@H](O)[C@@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph