calysolin II

Properties Image Occurences in reactions MNX_ID MNXM103463 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C66H110O30 charge 0 mass 1382.70819 reference chebi:68897 InChIKey DFZYDYFJPRQWLY-KPYOPUIHSA-N InChI InChI=1S/C66H110O30/c1-12-16-22-25-38-26-23-20-18-17-19-21-24-27-42(70)89-54-47(75)44(72)39(28-67)86-63(54)82-30-41-51(91-59(79)32(6)14-3)53(92-60(80)33(7)15-4)49(77)62(88-41)94-52-45(73)40(29-68)87-66(95-55-46(74)43(71)36(10)83-64(55)85-38)57(52)96-65-56(93-61(81)34(8)35(9)69)48(76)50(37(11)84-65)90-58(78)31(5)13-2/h13,32-41,43-57,62-69,71-77H,12,14-30H2,1-11H3/b31-13+/t32-,33-,34-,35-,36+,37-,38-,39+,40+,41+,43+,44+,45+,46-,47-,48+,49+,50-,51+,52-,53+,54+,55+,56+,57+,62-,63+,64-,65-,66-/m0/s1 SMILES C/C=C(\C)C(=O)O[C@H]1[C@H](C)O[C@@H](O[C@H]2[C@H]3O[C@H](CO)[C@@H](O)[C@@H]2O[C@@H]2O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4OC(=O)CCCCCCCCC[C@H](CCCCC)O[C@@H]4O[C@H](C)[C@@H](O)[C@H](O)[C@H]4O3)[C@@H](OC(=O)[C@@H](C)CC)[C@H](OC(=O)[C@@H](C)CC)[C@H]2O)[C@H](OC(=O)[C@@H](C)[C@H](C)O)[C@@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph