| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:56:52 UTC |
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| Update Date | 2025-03-21 18:05:05 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00054716 |
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| Frequency | 58.7 |
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| Structure | |
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| Chemical Formula | C16H18N2O6 |
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| Molecular Mass | 334.1165 |
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| SMILES | O=C(O)CCC(NC(=O)c1ccc(N2CCCC2=O)cc1)C(=O)O |
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| InChI Key | OWQCZNXRXQMUKZ-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 heteromonocyclic compounds |
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| Alternative Parents | acylaminobenzoic acid and derivativesalpha amino acidsazacyclic compoundsbenzoyl derivativescarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativeshippuric acids and derivativeshydrocarbon derivativeslactamsn-acyl-alpha amino acidsorganic oxidesorganonitrogen compoundsorganopnictogen compoundsphenylpyrrolidinespyrrolespyrrolidine-2-onessecondary carboxylic acid amidestertiary carboxylic acid amides |
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| Substituents | 2-pyrrolidonemonocyclic benzene moietycarbonyl grouplactamcarboxylic acid1-phenylpyrrolidinearomatic heteromonocyclic compoundbenzoylbenzamideorganic oxidetertiary carboxylic acid amideorganonitrogen compoundalpha-amino acidorganopnictogen compoundpyrrolidinepyrrolidoneorganoheterocyclic compoundn-acyl-alpha amino acid or derivativesacylaminobenzoic acid or derivativesazacyclen-acyl-alpha-amino acidhippuric acid or derivativesbenzoic acid or derivativesglutamic acid or derivativescarboxamide groupsecondary carboxylic acid amideorganic oxygen compoundpyrroledicarboxylic acid or derivativeshydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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