Methyl-S-dihydroorotate

Properties Image MNX_ID MNXM168347 reference sabiorkM:25399 formula C6H8N2O4 global charge 0 mol weight 172.14 InChIKey LRRONAYCHITNSG-UHFFFAOYSA-N InChI InChI=1S/C6H8N2O4/c1-12-5(10)3-2-4(9)8-6(11)7-3/h3H,2H2,1H3,(H2,7,8,9,11) SMILES COC(=O)C1CC(O)=NC(O)=N1 MNX internals InChI (mnx) InChI=1/C6H8N2O4/c1-12-5(10)3-2-4(9)8-6(11)7-3/h3H,2H2,1H3,(H2,7,8,9,11)/t3? SMILES (mnx) [CH3:1][O:12][C:5]([CH:3]1[CH2:2][C:4]([OH:9])=[N:8][C:6]([OH:11])=[N:7]1)=[O:10]

Parent-child relations graph

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