| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:00:06 UTC |
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| Update Date | 2025-03-21 18:06:19 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00062417 |
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| Frequency | 49.7 |
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| Structure | |
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| Chemical Formula | C7H8N2O6 |
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| Molecular Mass | 216.0382 |
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| SMILES | O=C(O)C1=NC(C(=O)O)CC(C(=O)O)N1 |
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| InChI Key | XSDIMYRLXMVONB-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | amino acids, peptides, and analogues |
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| Direct Parent | alpha amino acids |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | amidinesazacyclic compoundscarbonyl compoundscarboximidamidescarboxylic acidshydrocarbon derivativeshydropyrimidinesimidolactamsorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundstricarboxylic acids and derivatives |
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| Substituents | 1,4,5,6-tetrahydropyrimidinecarbonyl groupcarboxylic acidazacycletricarboxylic acid or derivativesorganic 1,3-dipolar compoundamidinecarboximidamidepropargyl-type 1,3-dipolar organic compoundorganic oxideorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidhydropyrimidineorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundimidolactamorganoheterocyclic compoundorganooxygen compound |
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