Pelargonidin 3-O-(6-caffeoyl-beta-D-glucoside)

Properties Image Occurences in reactions MNX_ID MNXM92533 #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0 formula C30H27O13 charge 1 mass 595.14462 reference chebi:80433 InChIKey OUWGZZOPFVOIFO-SHPGVJHPSA-O InChI InChI=1S/C30H26O13/c31-16-5-3-15(4-6-16)29-23(12-18-20(34)10-17(32)11-22(18)41-29)42-30-28(39)27(38)26(37)24(43-30)13-40-25(36)8-2-14-1-7-19(33)21(35)9-14/h1-12,24,26-28,30,37-39H,13H2,(H4-,31,32,33,34,35,36)/p+1/t24-,26-,27+,28-,30-/m1/s1 SMILES O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph