| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:40:01 UTC |
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| Update Date | 2025-03-21 17:58:35 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00015457 |
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| Frequency | 389.3 |
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| Structure | |
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| Chemical Formula | C6H13N3O2 |
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| Molecular Mass | 159.1008 |
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| SMILES | CC(C)C(NC(=N)N)C(=O)O |
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| InChI Key | KRDSZDZVHLBUMZ-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 | valine and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha amino acidscarbonyl compoundscarboximidamidescarboxylic acidsguanidineshydrocarbon derivativesiminesmethyl-branched fatty acidsmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compounds |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidmethyl-branched fatty acidguanidineiminevaline or derivativesfatty acidcarboximidamidebranched fatty acidorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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