1-[(2R,3S,6S)-6-(2-aminoethyl)-2-(hydroxymethyl)-3-oxanyl]-3-propan-2-ylurea

Properties Image MNX_ID MNXM339384 reference chebi:100993 formula C12H25N3O3 global charge 0 mol weight 259.35 InChIKey RKCCKXKETMZMSY-DCAQKATOSA-N InChI InChI=1S/C12H25N3O3/c1-8(2)14-12(17)15-10-4-3-9(5-6-13)18-11(10)7-16/h8-11,16H,3-7,13H2,1-2H3,(H2,14,15,17)/t9-,10-,11-/m0/s1 SMILES CC(C)NC(=O)N[C@H]1CC[C@@H](CCN)O[C@H]1CO MNX internals InChI (mnx) InChI=1/C12H25N3O3/c1-8(2)14-12(17)15-10-4-3-9(5-6-13)18-11(10)7-16/h8-11,16H,3-7,13H2,1-2H3,(H2,14,15,17)/t9-,10-,11-/m0/s1 SMILES (mnx) [CH3:1][CH:8]([CH3:2])[N:14]=[C:12]([NH:15][C@H:10]1[CH2:4][CH2:3][C@@H:9]([CH2:5][CH2:6][NH2:13])[O:18][C@H:11]1[CH2:7][OH:16])[OH:17]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0