bisdeacylplatyconin

Properties Image Occurences in reactions MNX_ID MNXM1106810 #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0 formula C33H40O21 charge 0 mass 772.20621 reference seedM:cpd33225 InChIKey RNPFWTUNILZAAJ-AYHDLMLWSA-N InChI InChI=1S/C33H40O21/c1-9-20(38)24(42)27(45)31(49-9)48-8-19-23(41)26(44)29(47)33(54-19)52-17-6-12-13(35)4-11(50-32-28(46)25(43)22(40)18(7-34)53-32)5-16(12)51-30(17)10-2-14(36)21(39)15(37)3-10/h2-6,9,18-20,22-29,31-34,38,40-47H,7-8H2,1H3,(H3-,35,36,37,39)/t9-,18-,19-,20-,22-,23-,24+,25+,26+,27+,28-,29-,31-,32-,33-/m1/s1 SMILES C[C@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3cc4c([O-])cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc4[o+]c3-c3cc(O)c(O)c(O)c3)[C@H](O)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph