| Record Information |
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| Version | 1.0 |
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| Creation Date | 2016-09-30 22:36:34 UTC |
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| Update Date | 2020-05-11 20:37:58 UTC |
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| BMDB ID | BMDB0000788 |
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| Secondary Accession Numbers | |
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| Metabolite Identification |
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| Common Name | Orotidine |
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| Description | Orotidine, also known as 6-carboxyuridine, belongs to the class of organic compounds known as pyrimidine nucleosides. Pyrimidine nucleosides are compounds comprising a pyrimidine base attached to a ribosyl or deoxyribosyl moiety. Orotidine, with regard to humans, has been found to be associated with the diseases such as uremia; orotidine has also been linked to the inborn metabolic disorder orotic aciduria I. Based on a literature review a significant number of articles have been published on Orotidine. |
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| Structure | |
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| Synonyms | | Value | Source |
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| 3-Ribofuranosylorotic acid | ChEBI | | 6-Carboxyuridine | ChEBI | | 3-Ribofuranosylorotate | Generator | | Orotic acid riboside | HMDB | | Orotidine, ammonium salt | HMDB |
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| Chemical Formula | C10H12N2O8 |
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| Average Molecular Weight | 288.2109 |
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| Monoisotopic Molecular Weight | 288.05936537 |
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| IUPAC Name | 3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid |
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| Traditional Name | orotidine |
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| CAS Registry Number | 314-50-1 |
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| SMILES | OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C(=O)NC(=O)C=C1C(O)=O |
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| InChI Identifier | InChI=1S/C10H12N2O8/c13-2-4-6(15)7(16)8(20-4)12-3(9(17)18)1-5(14)11-10(12)19/h1,4,6-8,13,15-16H,2H2,(H,17,18)(H,11,14,19)/t4-,6-,7-,8-/m1/s1 |
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| InChI Key | FKCRAVPPBFWEJD-XVFCMESISA-N |
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| Chemical Taxonomy |
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| Description | belongs to the class of organic compounds known as pyrimidine nucleosides. Pyrimidine nucleosides are compounds comprising a pyrimidine base attached to a ribosyl or deoxyribosyl moiety. |
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| Kingdom | Organic compounds |
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| Super Class | Nucleosides, nucleotides, and analogues |
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| Class | Pyrimidine nucleosides |
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| Sub Class | Not Available |
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| Direct Parent | Pyrimidine nucleosides |
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| Alternative Parents | |
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| Substituents | - Pyrimidine nucleoside
- Glycosyl compound
- N-glycosyl compound
- Pentose monosaccharide
- Hydropyrimidine carboxylic acid derivative
- Pyrimidine-6-carboxylic acid
- Pyrimidine-6-carboxylic acid or derivatives
- Hydroxypyrimidine
- Pyrimidone
- Hydropyrimidine
- Monosaccharide
- Pyrimidine
- Heteroaromatic compound
- Tetrahydrofuran
- Secondary alcohol
- Azacycle
- Carboxylic acid derivative
- Oxacycle
- Organoheterocyclic compound
- Carboxylic acid
- Monocarboxylic acid or derivatives
- Hydrocarbon derivative
- Organonitrogen compound
- Alcohol
- Organopnictogen compound
- Organic oxygen compound
- Organic nitrogen compound
- Organooxygen compound
- Organic oxide
- Primary alcohol
- Aromatic heteromonocyclic compound
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| Molecular Framework | Aromatic heteromonocyclic compounds |
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| External Descriptors | |
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| Ontology |
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| Status | Expected but not Quantified |
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| Origin | |
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| Biofunction | Not Available |
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| Application | Not Available |
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| Cellular locations | |
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| Physical Properties |
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| State | Solid |
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| Experimental Properties | | Property | Value | Reference |
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| Melting Point | > 400 °C | Not Available | | Boiling Point | Not Available | Not Available | | Water Solubility | Not Available | Not Available | | LogP | Not Available | Not Available |
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| Predicted Properties | |
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| Spectra |
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| Spectra | |
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