Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:55:03 UTC |
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Update Date | 2025-03-25 00:51:53 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02190039 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C10H11NO4 |
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Molecular Mass | 209.0688 |
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SMILES | C=CCC(NC(=O)c1ccco1)C(=O)O |
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InChI Key | NAZCNWZIMVAMLW-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 | n-acyl-alpha amino acids |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | 2-heteroaryl carboxamidesalpha amino acidscarbonyl compoundscarboxylic acidsfuroic acid and derivativesheteroaromatic compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundssecondary carboxylic acid amides |
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Substituents | furancarbonyl groupcarboxylic acidaromatic heteromonocyclic compound2-heteroaryl carboxamideorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundfuroic acid or derivativesn-acyl-alpha-amino acidheteroaromatic compoundcarboxamide groupoxacyclesecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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