Record Information |
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Version |
1.0 |
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Update Date |
1/22/2018 12:54:54 PM |
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Metabolite ID | PAMDB110029 |
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Identification |
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Name: |
S-ureidoglycolate |
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Description: | Conjugate base of (−)-ureidoglycolic acid. |
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Structure |
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Synonyms: | -
(-)-ureidoglycolate
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ureidoglycolate
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S-(-)-ureidoglycolate
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Chemical Formula: |
C3H5N2O4
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Average Molecular Weight: |
133.08 |
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Monoisotopic Molecular
Weight: |
134.0327566914 |
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InChI Key: |
NWZYYCVIOKVTII-SFOWXEAESA-M |
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InChI: |
InChI=1S/C3H6N2O4/c4-3(9)5-1(6)2(7)8/h1,6H,(H,7,8)(H3,4,5,9)/p-1/t1-/m0/s1 |
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CAS
number: |
7424-03-5 |
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IUPAC Name: | (2S)-(carbamoylamino)(hydroxy)acetate |
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Traditional IUPAC Name: |
ureidoglycolate |
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SMILES: | C(O)(C([O-])=O)NC(N)=O |
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Chemical Taxonomy |
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Taxonomy Description | This compound belongs to the class of chemical entities known as n-carbamoyl-alpha amino acids. These are compounds containing an alpha amino acid which bears an carbamoyl group at its terminal nitrogen atom. |
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Kingdom |
Chemical entities |
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Super Class | Organic compounds |
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Class |
Organic acids and derivatives |
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Sub Class | Carboxylic acids and derivatives |
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Direct Parent |
N-carbamoyl-alpha amino acids |
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Alternative Parents |
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Substituents |
- N-carbamoyl-alpha-amino acid
- Ureide
- Alpha-hydroxy acid
- Hydroxy acid
- Urea
- Alkanolamine
- Carboxylic acid
- Monocarboxylic acid or derivatives
- Organic nitrogen compound
- Organonitrogen compound
- Organooxygen compound
- Hydrocarbon derivative
- Organic oxide
- Organopnictogen compound
- Carbonyl group
- Organic oxygen compound
- Aliphatic acyclic compound
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Molecular Framework |
Aliphatic acyclic compounds |
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External Descriptors |
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Physical Properties |
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State: |
Solid |
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Charge: | -1 |
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Melting point: |
Not Available |
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Experimental Properties: |
Property | Value | Reference |
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Melting Point | Not Available | 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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Biological Properties |
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Cellular Locations: |
Not Available |
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Reactions: | |
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Pathways: |
- allantoin degradation IV (anaerobic)PWY0-41
- allantoin degradation to ureidoglycolate I (urea producing)PWY-5697
- superpathway of allantoin degradation in plantsURDEGR-PWY
- allantoin degradation to glyoxylate IPWY-5694
- allantoin degradation to ureidoglycolate II (ammonia producing)PWY-5698
- allantoin degradation to glyoxylate IIIPWY-5705
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Spectra |
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Spectra: |
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References |
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References: |
Not Available |
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Synthesis Reference: |
Not Available |
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Material Safety Data Sheet (MSDS) |
Not Available |
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Links |
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External Links: |
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