| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:08:03 UTC |
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| Update Date | 2025-03-21 18:30:13 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00081536 |
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| Frequency | 46.3 |
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| Structure | |
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| Chemical Formula | C7H16N4O |
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| Molecular Mass | 172.1324 |
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| SMILES | CC(C)CC(N)C(=O)NC(=N)N |
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| InChI Key | SJGJGECITJRGQC-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 | leucine and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha amino acid amidesalpha amino acidscarbonyl compoundscarboximidamidescarboxylic acids and derivativesguanidineshydrocarbon derivativesiminesmonoalkylaminesn-acyl aminesorganic oxidesorganopnictogen compounds |
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| Substituents | aliphatic acyclic compoundcarbonyl groupalpha-amino acid amideguanidineiminecarboximidamiden-acyl-amineorganic oxideorganic oxygen compoundleucine or derivativesorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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