(22R,23R)-28-homocastasterone 22-O-sulfate

Properties Image Occurences in reactions MNX_ID MNXM13509 #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0 formula C29H49O8S charge -1 mass 557.31536 reference metacycM:CPD-11828 InChIKey MXFYIPZNENWPSK-BSBOPDPFSA-M InChI InChI=1S/C29H50O8S/c1-7-17(15(2)3)26(33)27(37-38(34,35)36)16(4)19-8-9-20-18-12-23(30)22-13-24(31)25(32)14-29(22,6)21(18)10-11-28(19,20)5/h15-22,24-27,31-33H,7-14H2,1-6H3,(H,34,35,36)/p-1/t16-,17-,18?,19?,20?,21?,22+,24-,25+,26+,27+,28+,29+/m0/s1 SMILES CC[C@@H](C(C)C)[C@@H](O)[C@H](OS(=O)(=O)[O-])[C@@H](C)C1CCC2C3CC(=O)[C@H]4C[C@H](O)[C@H](O)C[C@]4(C)C3CC[C@@]21C

Parent-child relations graph

Deprecated MNXref IDs graph