| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:14:12 UTC |
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| Update Date | 2025-03-21 18:33:29 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00096079 |
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| Frequency | 28.8 |
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| Structure | |
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| Chemical Formula | C9H16N2O2 |
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| Molecular Mass | 184.1212 |
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| SMILES | CCCC=CCC(NC=N)C(=O)O |
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| InChI Key | FXSHVYCZZMAGBB-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 acyclic compounds |
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| Alternative Parents | amino fatty acidscarbonyl compoundscarboximidamidescarboxylic acidsfatty acylsformamidineshydrocarbon derivativesiminesmedium-chain fatty acidsmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compounds |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidimineamidinecarboximidamideamino fatty acidformamidineorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativemedium-chain fatty acidorganic nitrogen compoundorganooxygen compound |
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