| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:29:20 UTC |
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| Update Date | 2025-03-21 18:41:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00132585 |
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| Frequency | 19.0 |
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| Structure | |
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| Chemical Formula | C18H23N3O5 |
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| Molecular Mass | 361.1638 |
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| SMILES | O=C(O)CCC(NC(=O)c1ccc(N2CC3CCCN3C2)cc1)C(=O)O |
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| InChI Key | UNJXGXBDGIKWIW-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 | glutamic acid and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alpha amino acidsaniline and substituted anilinesazacyclic compoundsbenzoyl derivativescarbonyl compoundscarboxylic acidsdialkylarylaminesdicarboxylic acids and derivativeshippuric acids and derivativeshydrocarbon derivativesn-acyl-alpha amino acidsn-alkylpyrrolidinesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsphenylimidazolidinessecondary carboxylic acid amides |
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| Substituents | imidazolidinemonocyclic benzene moietycarbonyl groupcarboxylic acidphenylimidazolidinebenzoylbenzamideorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compounddialkylarylaminepyrrolidineorganoheterocyclic compoundn-acyl-alpha amino acid or derivativesazacyclen-acyl-alpha-amino acidn-alkylpyrrolidinehippuric acid or derivativesaniline or substituted anilinesbenzoic acid or derivativesglutamic acid or derivativescarboxamide groupsecondary carboxylic acid amideorganic oxygen compounddicarboxylic acid or derivativeshydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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