(R)-oxamniquine

Properties Image MNX_ID MNXM149656 reference chebi:78417 formula C14H21N3O3 global charge 0 mol weight 279.34 InChIKey XCGYUJZMCCFSRP-GFCCVEGCSA-N InChI InChI=1S/C14H21N3O3/c1-9(2)15-7-12-4-3-10-5-11(8-18)14(17(19)20)6-13(10)16-12/h5-6,9,12,15-16,18H,3-4,7-8H2,1-2H3/t12-/m1/s1 SMILES CC(C)NC[C@H]1CCC2=C(C=C([N+](=O)[O-])C(CO)=C2)N1 MNX internals InChI (mnx) InChI=1/C14H21N3O3/c1-9(2)15-7-12-4-3-10-5-11(8-18)14(17(19)20)6-13(10)16-12/h5-6,9,12,15-16,18H,3-4,7-8H2,1-2H3/t12-/m1/s1 SMILES (mnx) [CH3:1][CH:9]([CH3:2])[NH:15][CH2:7][C@H:12]1[CH2:4][CH2:3][C:10]2=[CH:5][C:11]([CH2:8][OH:18])=[C:14]([N+:17]([O-:19])=[O:20])[CH:6]=[C:13]2[NH:16]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0