| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:07:25 UTC |
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| Update Date | 2025-03-25 00:56:27 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02218478 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H20N2O5 |
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| Molecular Mass | 320.1372 |
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| SMILES | Cc1ccccc1C(=O)NC(CCN1CCC1C(=O)O)C(=O)O |
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| InChI Key | NXMGLTAMBJOKLU-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | benzoic acids and derivatives |
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| Direct Parent | hippuric acids and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acidsamino acidsamino fatty acidsazacyclic compoundsazetidinecarboxylic acidsazetidinesbenzoyl derivativescarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativesfatty acylshydrocarbon derivativesn-acyl-alpha amino acidsorganic oxidesorganopnictogen compoundssecondary carboxylic acid amidestrialkylamineso-toluamides |
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| Substituents | fatty acylcarbonyl groupcarboxylic acidaromatic heteromonocyclic compoundamino acid or derivativesamino acidbenzoylazetidinecarboxylic acidalpha-amino acid or derivativescarboxylic acid derivativetoluamideorganic oxideo-toluamidealpha-amino acidorganonitrogen compoundorganopnictogen compoundtertiary amineorganoheterocyclic compoundn-acyl-alpha amino acid or derivativesazacyclen-acyl-alpha-amino acidhippuric acid or derivativestertiary aliphatic amineamino fatty acidcarboxamide groupazetidinesecondary carboxylic acid amideorganic oxygen compounddicarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundtolueneamineorganooxygen compound |
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