| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 13:20:47 UTC |
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| Update Date | 2025-03-24 22:01:57 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01968556 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C4H7N3O |
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| Molecular Mass | 113.0589 |
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| SMILES | NCC1N=CNC1=O |
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| InChI Key | TUUHIDNGYWLQQX-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 | beta amino acids and derivatives |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acidsazacyclic compoundscarbonyl compoundscarboximidamidescarboxylic acids and derivativeshydrocarbon derivativesimidazolinonesmonoalkylaminesorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | carbonyl groupazacycleorganic 1,3-dipolar compoundalpha-amino acid or derivativescarboximidamidebeta amino acid or derivativespropargyl-type 1,3-dipolar organic compoundorganic oxideorganic oxygen compound2-imidazolineimidazolinealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundimidazolinonehydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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