S-(+)-3,6,8-trimethylallantoin

Properties Image MNX_ID MNXM6778 reference metacycM:CPD-16699 formula C7H12N4O3 global charge 0 mol weight 200.198 InChIKey SUPBSHBVIKDGQN-BYPYZUCNSA-N InChI InChI=1S/C7H12N4O3/c1-8-6(13)10(2)4-5(12)11(3)7(14)9-4/h4H,1-3H3,(H,8,13)(H,9,14)/t4-/m0/s1 SMILES CNC(=O)N(C)[C@@H]1NC(=O)N(C)C1=O MNX internals InChI (mnx) InChI=1/C7H12N4O3/c1-8-6(13)10(2)4-5(12)11(3)7(14)9-4/h4H,1-3H3,(H,8,13)(H,9,14)/t4-/m0/s1 SMILES (mnx) [CH3:1][N:8]=[C:6]([N:10]([CH3:2])[C@H:4]1[C:5](=[O:12])[N:11]([CH3:3])[C:7]([OH:14])=[N:9]1)[OH:13]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 8 in models (compartimentalized) 1