Record Information |
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HMDB Status | detected |
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Creation Date | 2024-02-20 23:36:54 UTC |
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Update Date | 2025-03-21 17:57:29 UTC |
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HMDB ID | HMDB0253469 |
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Metabolite Identification |
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DeepMet ID | DMID00008241 |
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Name | Indole-5-carboxylic acid |
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Frequency | 596.9 |
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Structure | |
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Chemical Formula | C9H7NO2 |
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Molecular Mass | 161.0477 |
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SMILES | O=C(O)c1ccc2[nH]ccc2c1 |
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InChI Key | IENZCGNHSIMFJE-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 | azacyclic compoundsbenzenoidscarboxylic acidsheteroaromatic compoundshydrocarbon derivativesindolesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspyrroles |
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Substituents | carboxylic acidazacycleindoleheteroaromatic compoundcarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaromatic heteropolycyclic compoundindolecarboxylic acidpyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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