1-[[(3S,9S,10R)-16-[[(1,3-benzodioxol-5-ylamino)-oxomethyl]amino]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-3-cyclohexyl-1-methylurea

Properties Image Occurences in reactions MNX_ID MNXM341715 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C37H53N5O8 charge 0 mass 695.38941 reference chebi:128003 InChIKey XITHNPJDKKPLRP-YUKNNVIKSA-N InChI InChI=1S/C37H53N5O8/c1-24-20-42(25(2)22-43)35(44)30-18-28(38-36(45)39-29-14-16-32-33(19-29)49-23-48-32)13-15-31(30)50-26(3)10-8-9-17-47-34(24)21-41(4)37(46)40-27-11-6-5-7-12-27/h13-16,18-19,24-27,34,43H,5-12,17,20-23H2,1-4H3,(H,40,46)(H2,38,39,45)/t24-,25-,26+,34-/m1/s1 SMILES C[C@H]1CCCCO[C@H](CN(C)C(=O)NC2CCCCC2)[C@H](C)CN([C@H](C)CO)C(=O)c2cc(NC(=O)Nc3ccc4c(c3)OCO4)ccc2O1

Parent-child relations graph

Deprecated MNXref IDs graph