3,5-di-O-(beta-Glucopyranosyl) pelargonidin 6''-O-4, 6'''-O-1-cyclic malate

Properties Image Occurences in reactions MNX_ID MNXM26537 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C31H33O18 charge 1 mass 693.16614 reference lipidmapsM:LMPK12010067 InChIKey MDSZBCFPVUABGB-SVUMSXGASA-O InChI InChI=1S/C31H32O18/c32-12-3-1-11(2-4-12)28-18-7-14-16(45-28)5-13(33)6-17(14)46-30-26(40)25(39)23(37)20(49-30)10-44-29(42)15(34)8-21(35)43-9-19-22(36)24(38)27(41)31(47-18)48-19/h1-7,15,19-20,22-27,30-31,34,36-41H,8-10H2,(H-,32,33)/p+1/t15?,19-,20-,22-,23-,24?,25?,26-,27?,30?,31-/m1/s1 SMILES O=C1CC(O)C(=O)OC[C@H]2OC(Oc3cc(O)cc4[o+]c(-c5ccc(O)cc5)c(cc34)O[C@@H]3O[C@H](CO1)[C@@H](O)C(O)C3O)[C@H](O)C(O)[C@@H]2O

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Deprecated MNXref IDs graph