1-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-3-oxanyl]-3-propylurea

Properties Image MNX_ID MNXM339794 reference chebi:122224 formula C17H32N4O4 global charge 0 mol weight 356.467 InChIKey XCSADXMQLTVTGS-SOUVJXGZSA-N InChI InChI=1S/C17H32N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h13-15,22H,3-12H2,1-2H3,(H2,18,19,24)/t13-,14-,15+/m0/s1 SMILES CCCNC(=O)N[C@H]1CC[C@@H](CC(=O)N2CCN(C)CC2)O[C@@H]1CO MNX internals InChI (mnx) InChI=1/C17H32N4O4/c1-3-6-18-17(24)19-14-5-4-13(25-15(14)12-22)11-16(23)21-9-7-20(2)8-10-21/h13-15,22H,3-12H2,1-2H3,(H2,18,19,24)/t13-,14-,15+/m0/s1 SMILES (mnx) [CH3:1][CH2:3][CH2:6][N:18]=[C:17]([NH:19][C@H:14]1[CH2:5][CH2:4][C@@H:13]([CH2:11][C:16]([N:21]2[CH2:9][CH2:7][N:20]([CH3:2])[CH2:8][CH2:10]2)=[O:23])[O:25][C@@H:15]1[CH2:12][OH:22])[OH:24]

Parent-child relations graph

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