Atractyloside E

Properties Image Occurences in reactions MNX_ID MNXM42956 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C32H54O16 charge 0 mass 694.34119 reference keggC:C17862 InChIKey QSTRBHATEJGVOL-VQNZKERUSA-N InChI InChI=1S/C32H54O16/c1-14-7-16(45-27-24(39)23(38)21(36)19(47-27)11-43-29-26(41)32(42,12-34)13-44-29)9-31(4)6-5-15(8-17(14)31)30(2,3)48-28-25(40)22(37)20(35)18(10-33)46-28/h15-29,33-42H,1,5-13H2,2-4H3/t15-,16+,17+,18-,19-,20-,21-,22+,23+,24-,25-,26+,27-,28+,29-,31+,32-/m1/s1 SMILES C=C1C[C@H](O[C@@H]2O[C@H](CO[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)C[C@]2(C)CC[C@@H](C(C)(C)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@@H]12

Parent-child relations graph

Deprecated MNXref IDs graph