Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:22:33 UTC |
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Update Date | 2025-03-21 18:37:38 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00116538 |
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Frequency | 22.5 |
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Structure | |
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Chemical Formula | C13H11NO3 |
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Molecular Mass | 229.0739 |
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SMILES | O=C(O)c1ccc(Nc2ccc(O)cc2)cc1 |
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InChI Key | ROXSWPDJVVHMEQ-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 | benzoic acids |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsamino acidsbenzoyl derivativescarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundssecondary amines |
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Substituents | carboxylic acidamino acid or derivativesamino acidbenzoyl1-hydroxy-2-unsubstituted benzenoidsecondary aminecarboxylic acid derivativearomatic homomonocyclic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundphenolhydrocarbon derivativeorganic nitrogen compoundbenzoic acidorganooxygen compoundamine |
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