Hydroorotic acid, L-
(4S)-2,6-dioxo-1,3-diazinane-4-carboxylic acid
Molecular Identity
Hydroorotic acid, L-
(4S)-2,6-dioxo-1,3-diazinane-4-carboxylic acid
PubChem CID: 439216
(S)-dihydroorotic acid is the (S)-enantiomer of dihydroorotic acid that is an intermediate in the metabolism of pyridine. It has a role as a mouse metabolite, a Saccharomyces cerevisiae metabolite, an Escherichia coli metabolite and a human metabolite. It is a conjugate acid of a (S)-dihydroorotate. It is an enantiomer of a (R)-dihydroorotic acid.
2D Structure
Properties
C5H6N2O4
Molecular Formula
158.11
Molecular Weight
g/mol
158.0328
Exact Mass
Da
-1.5
XLogP
Drug-like (Lipinski: < 5)
95.5
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
4
H-Bond Acceptors
225
Complexity
SMILES
Canonical SMILES
SMILES: C1C(NC(=O)NC1=O)C(=O)OIsomeric SMILES
SMILES: C1[C@H](NC(=O)NC1=O)C(=O)OSynonyms(20)
L-Dihydroorotic acidHydroorotic acid, L-(4S)-2,6-dioxo-1,3-diazinane-4-carboxylic acidL-5,6-dihydroorotic acid4-Pyrimidinecarboxylic acid, hexahydro-2,6-dioxo-, (4S)-Hydroorotic acid L-form [MI](4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-4-CARBOXYLIC ACIDDTXSID30331399RefChem:789381HYDROOROTIC ACID L-FORMDTXCID30282493624-952-75988-19-2(S)-2,6-Dioxohexahydropyrimidine-4-carboxylic acidL-dihydroorotate
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Hydroorotic acid, L-
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