brassinolide 22-O-sulfate

Properties Image Occurences in reactions MNX_ID MNXM818378 #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0 formula C28H47O9S charge -1 mass 559.29463 reference metacycM:CPD-19794 InChIKey MDJSEODEPHDJBE-XZDDVQLQSA-M InChI InChI=1S/C28H48O9S/c1-14(2)15(3)24(31)25(37-38(33,34)35)16(4)18-7-8-19-17-13-36-26(32)21-11-22(29)23(30)12-28(21,6)20(17)9-10-27(18,19)5/h14-25,29-31H,7-13H2,1-6H3,(H,33,34,35)/p-1/t15-,16-,17?,18?,19-,20?,21+,22-,23+,24+,25+,27+,28+/m0/s1 SMILES CC(C)[C@H](C)[C@@H](O)[C@H](OS(=O)(=O)[O-])[C@@H](C)C1CC[C@H]2C3COC(=O)[C@H]4C[C@H](O)[C@H](O)C[C@]4(C)C3CC[C@]12C

Parent-child relations graph

Deprecated MNXref IDs graph