1alpha,25-dihydroxy-26,27-dimethyl-22-thia-20-epivitamin D3 / 1alpha,25-dihydroxy-26,27-dimethyl-22-thia-20-epicholecalciferol

Properties Image Occurences in reactions MNX_ID MNXM33960 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C28H46O3S charge 0 mass 462.31677 reference lipidmapsM:LMST03020374 InChIKey FCVBMDNXQPPSEE-BSGGSXJLSA-N InChI InChI=1S/C28H46O3S/c1-6-28(31,7-2)15-16-32-20(4)24-12-13-25-21(9-8-14-27(24,25)5)10-11-22-17-23(29)18-26(30)19(22)3/h10-11,20,23-26,29-31H,3,6-9,12-18H2,1-2,4-5H3/b21-10+,22-11-/t20-,23-,24-,25+,26+,27-/m1/s1 SMILES C=C1/C(=C\C=C2/CCC[C@]3(C)[C@@H]([C@@H](C)SCCC(O)(CC)CC)CC[C@@H]23)C[C@@H](O)C[C@@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph