20-hydroxyecdysonate

Properties Image Occurences in reactions MNX_ID MNXM147753 #reac in my sandbox 0 in MNXref (generic) 4 in models (compartimentalized) 0 formula C27H41O9 charge -1 mass 509.27561 reference metacycM:CPD-15602 InChIKey CBVIQTRBPLDFEH-CPDIQSOBSA-M InChI InChI=1S/C27H42O9/c1-23-13-19(30)18(29)12-16(23)17(28)11-15-14(23)5-8-24(2)20(6-10-27(15,24)36)26(4,35)21(31)7-9-25(3,34)22(32)33/h11,14,16,18-21,29-31,34-36H,5-10,12-13H2,1-4H3,(H,32,33)/p-1/t14-,16-,18+,19-,20-,21+,23+,24+,25?,26?,27+/m0/s1 SMILES CC(O)(CC[C@@H](O)C(C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C)C(=O)[O-]

Parent-child relations graph

Deprecated MNXref IDs graph