Pelargonidin 3-O-3'',6''-O-dimalonylglucoside

Properties Image Occurences in reactions MNX_ID MNXM12594 #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0 formula C27H25O16 charge 1 mass 605.11371 reference chebi:80424 InChIKey FYXSNZOHHSEKPD-MQWSOPDOSA-O InChI InChI=1S/C27H24O16/c28-12-3-1-11(2-4-12)25-17(7-14-15(30)5-13(29)6-16(14)40-25)41-27-24(38)26(43-22(36)9-20(33)34)23(37)18(42-27)10-39-21(35)8-19(31)32/h1-7,18,23-24,26-27,37-38H,8-10H2,(H4-,28,29,30,31,32,33,34)/p+1/t18-,23-,24-,26+,27-/m1/s1 SMILES O=C(O)CC(=O)OC[C@H]1O[C@@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2ccc(O)cc2)[C@H](O)[C@@H](OC(=O)CC(=O)O)[C@@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph