| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:07:27 UTC |
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| Update Date | 2025-03-21 18:29:53 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00080117 |
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| Frequency | 55.0 |
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| Structure | |
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| Chemical Formula | C9H8N2O3 |
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| Molecular Mass | 192.0535 |
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| SMILES | O=C(O)C1Nc2ccccc2NC1=O |
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| InChI Key | QUUDQDSWVWOIPR-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 | alpha amino acids |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1,3-dicarbonyl compoundsamino acidsazacyclic compoundsbenzenoidscarboxylic acidshydrocarbon derivativeslactamsmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundssecondary alkylarylaminessecondary carboxylic acid amides |
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| Substituents | carbonyl grouplactamcarboxylic acidamino acidorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundazacyclesecondary aminecarboxamide groupsecondary aliphatic/aromatic aminesecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativebenzenoidorganic nitrogen compound1,3-dicarbonyl compoundamineorganooxygen compound |
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