Molecule ID: 5460289

IUPAC Name: (4S)-2,6-dioxo-1,3-diazinane-4-carboxylate

Description: The molecule is a dihydroorotate that is the conjugate base of (S)-dihydroorotic acid. It has a role as a human metabolite and a Saccharomyces cerevisiae metabolite. It is a conjugate base of a (S)-dihydroorotic acid.

SMILES: O=C(O)[C@@H]1CC([O-])=NC(O)=N1

SELFIES: [O][=C][Branch1][C][O][C@@H1][C][C][Branch1][C][O-1][=N][C][Branch1][C][O][=N][Ring1][Branch2]

InChI: InChI=1S/C5H6N2O4/c8-3-1-2(4(9)10)6-5(11)7-3/h2H,1H2,(H,9,10)(H2,6,7,8,11)/p-1/t2-/m0/s1

Molecular Properties:
- Polar Surface Area: 98.3 Ų
- LogP: -0.9