| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:55:26 UTC |
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| Update Date | 2025-03-21 18:04:34 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00051484 |
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| Frequency | 94.9 |
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| Structure | |
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| Chemical Formula | C9H7NO3 |
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| Molecular Mass | 177.0426 |
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| SMILES | O=C1NC(C(=O)O)c2ccccc21 |
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| InChI Key | GWTFROOJKYYIGZ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbohydrates and carbohydrate conjugates |
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| Direct Parent | bicyclic amino acids and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alpha amino acidsazacyclic compoundsbenzenoidscarbonyl compoundscarboxylic acidshydrocarbon derivativesisoindolesisoindoloneslactamsmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amides |
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| Substituents | bicyclic amino acidcarbonyl grouplactamcarboxylic acidalpha-amino acid or derivativescarboxylic acid derivativeisoindoloneorganic oxideisoindolinearomatic heteropolycyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundazacycleisoindolecarboxamide groupsecondary carboxylic acid amidemonocarboxylic acid or derivativesisoindole or derivativeshydrocarbon derivativebenzenoidorganic nitrogen compound |
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