| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:13:24 UTC |
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| Update Date | 2025-03-21 18:33:04 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00094165 |
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| Frequency | 29.6 |
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| Structure | |
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| Chemical Formula | C13H23N3O5 |
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| Molecular Mass | 301.1638 |
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| SMILES | CC(C)C(N)C(=O)NC(CCN1CCC1C(=O)O)C(=O)O |
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| InChI Key | AOWAWFHRKBVZIO-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 | dipeptides |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acid amidesalpha amino acidsamino acidsamino fatty acidsazacyclic compoundsazetidinecarboxylic acidsazetidinesbranched fatty acidscarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativesheterocyclic fatty acidshydrocarbon derivativesmonoalkylaminesn-acyl aminesn-acyl-alpha amino acidsorganic oxidesorganopnictogen compoundssecondary carboxylic acid amidestrialkylaminesvaline and derivatives |
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| Substituents | fatty acylcarbonyl groupcarboxylic acidamino acid or derivativesamino acidheterocyclic fatty acidfatty amidefatty acidazetidinecarboxylic acidalpha-amino acid or derivativesorganic oxidealiphatic heteromonocyclic compoundalpha-amino acidorganonitrogen compoundorganopnictogen compoundtertiary amineorganoheterocyclic compoundn-acyl-alpha amino acid or derivativesalpha-amino acid amideazacyclen-acyl-alpha-amino acidvaline or derivativestertiary aliphatic amineamino fatty acidcarboxamide groupbranched fatty acidn-acyl-amineazetidinealpha-dipeptidesecondary carboxylic acid amideorganic oxygen compounddicarboxylic acid or derivativeshydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundamineorganooxygen compound |
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