myricetin 3-O-gentiobioside

Properties Image Occurences in reactions MNX_ID MNXM114709 #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0 formula C27H30O18 charge 0 mass 642.14321 reference metacycM:CPD-14844 InChIKey HUHZBMAVCTZCMX-IWUZQBPLSA-N InChI InChI=1S/C27H30O18/c28-5-13-17(34)20(37)22(39)26(43-13)41-6-14-18(35)21(38)23(40)27(44-14)45-25-19(36)15-9(30)3-8(29)4-12(15)42-24(25)7-1-10(31)16(33)11(32)2-7/h1-4,13-14,17-18,20-23,26-35,37-40H,5-6H2/t13-,14-,17-,18-,20+,21+,22-,23-,26-,27+/m1/s1 SMILES O=c1c(O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c(-c2cc(O)c(O)c(O)c2)oc2cc(O)cc(O)c12

Parent-child relations graph

Deprecated MNXref IDs graph