| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:06:10 UTC |
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| Update Date | 2025-03-21 18:29:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00076973 |
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| Frequency | 38.2 |
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| Structure | |
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| Chemical Formula | C9H9NO3 |
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| Molecular Mass | 179.0582 |
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| SMILES | O=C(O)C1Cc2ccccc2N1O |
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| InChI Key | CSBQANYYIUNFLQ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | indoles and derivatives |
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| Subclass | indolecarboxylic acids and derivatives |
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| Direct Parent | indolecarboxylic acids |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxylamino, 2-unsubstituted benzenoids1-hydroxylamino, 4-unsubstituted benzenoidsalpha amino acidsazacyclic compoundscarbonyl compoundscarboxylic acidshydrocarbon derivativesindolesmonocarboxylic acids and derivativesn-organohydroxylaminesorganic oxidesorganopnictogen compounds |
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| Substituents | carbonyl groupcarboxylic acidindolealpha-amino acid or derivativescarboxylic acid derivativeorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compound1-hydroxylamino, 2-unsubstituted benzenoidazacyclen-organohydroxylaminemonocarboxylic acid or derivativesorganic oxygen compoundindolecarboxylic acid1-hydroxylamino, 4-unsubstituted benzenoidhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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