| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 01:09:17 UTC |
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| Update Date | 2025-03-21 19:05:14 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00225741 |
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| Frequency | 9.6 |
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| Structure | |
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| Chemical Formula | C5H7N3O2 |
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| Molecular Mass | 141.0538 |
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| SMILES | CC(=O)NC1N=CNC1=O |
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| InChI Key | SOTOETPIMAHAQU-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 | n-acyl-alpha amino acids |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | acetamidesalpha amino acidsazacyclic compoundscarbonyl compoundscarboximidamidescarboxylic acids and derivativeshydrocarbon derivativesimidazolinonesorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundssecondary carboxylic acid amides |
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| Substituents | carbonyl grouppropargyl-type 1,3-dipolar organic compoundorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundimidazolinoneorganoheterocyclic compoundacetamideazacyclen-acyl-alpha-amino acidorganic 1,3-dipolar compoundcarboximidamidecarboxamide groupsecondary carboxylic acid amideorganic oxygen compound2-imidazolineimidazolinehydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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