| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:27:22 UTC |
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| Update Date | 2025-03-21 18:39:57 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00127919 |
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| Frequency | 19.9 |
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| Structure | |
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| Chemical Formula | C9H16N4O5 |
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| Molecular Mass | 260.1121 |
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| SMILES | N=C(NCCCC(N)=O)NC(CC(=O)O)C(=O)O |
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| InChI Key | ZUOFKSNXVMIEEZ-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 | aspartic acid and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha amino acidscarbonyl compoundscarboximidamidescarboxylic acidsdicarboxylic acids and derivativesfatty acids and conjugatesfatty amidesgamma amino acids and derivativesguanidineshydrocarbon derivativesiminesorganic oxidesorganopnictogen compoundsprimary carboxylic acid amides |
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| Substituents | primary carboxylic acid amidefatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidgamma amino acid or derivativesguanidineiminefatty amidefatty acidorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundcarboximidamidecarboxamide grouporganic oxygen compoundaspartic acid or derivativesdicarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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