| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 13:31:54 UTC |
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| Update Date | 2025-03-24 22:06:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01995047 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C4H5N3O2 |
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| Molecular Mass | 127.0382 |
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| SMILES | NC(=O)C1N=CNC1=O |
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| InChI Key | PXQCVBRDIZZRGM-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 | 1,3-dicarbonyl compoundsazacyclic compoundscarboximidamidescarboxylic acids and derivativeshydrocarbon derivativesimidazolinonesorganic oxidesorganopnictogen compoundsprimary carboxylic acid amidespropargyl-type 1,3-dipolar organic compounds |
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| Substituents | primary carboxylic acid amidecarbonyl groupazacycleorganic 1,3-dipolar compoundcarboximidamidecarboxamide grouppropargyl-type 1,3-dipolar organic compoundorganic oxideorganic oxygen compound2-imidazolineimidazolinealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundimidazolinonehydrocarbon derivativeorganic nitrogen compound1,3-dicarbonyl compoundorganoheterocyclic compoundorganooxygen compound |
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