DL-Dihydroorotic acid

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Systematic / IUPAC Name: 2,6-Dioxohexahydropyrimidine-4-carboxylic acid

ID: Reference409

Other Names: 2,6-Dioxohexahydro-4-pyrimidinecarboxylic acid;
4-Pyrimidinecarboxylic acid, hexahydro-2,6-dioxo-;
2,6-Dioxo-1,3,4,5-tetrahydropyrimidine-4-carboxylic acid;
4,5-Dihydroorotic acid;
Orotic acid, 4,5-dihydro-

Formula: C5H6N2O4

Class: Endogenous Metabolites

Spectral Data

DL-Dihydroorotic acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite
No. of Spectral Trees 2
No. of Spectra 206
Tandem Spectra MS1, MS2, MS3
Ionization Methods ESI
Analyzers FT
Last Modification 1/15/2015 3:30:33 PM
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Identificators

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)
InChI Key UFIVEPVSAGBUSI-UHFFFAOYSA-N
Canonical SMILES C1C(NC(=O)NC1=O)C(=O)O
CAS 155544
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Other Names 2,6-Dioxohexahydro-4-pyrimidinecarboxylic acid;
4-Pyrimidinecarboxylic acid, hexahydro-2,6-dioxo-;
2,6-Dioxo-1,3,4,5-tetrahydropyrimidine-4-carboxylic acid;
4,5-Dihydroorotic acid;
Orotic acid, 4,5-dihydro-

In Other Databases

ChEMBL CHEMBL75782
ChEBI CHEBI:30865
HMDb HMDB00528; HMDB00528
ChemIDPlus 000155544
Wikipedia 4,5-Dihydroorotic acid
ChemSpider 628
PubChem 648