| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:22:39 UTC |
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| Update Date | 2025-03-25 01:02:00 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02253122 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H7NO5 |
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| Molecular Mass | 233.0324 |
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| SMILES | O=C(O)C(=O)c1c(C(=O)O)[nH]c2ccccc12 |
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| InChI Key | CDRXMHIKDCBEQO-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 and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alpha-keto acids and derivativesaryl ketonesazacyclic compoundsbenzenoidscarboxylic acidsdicarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesindolesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrole 2-carboxylic acidspyrrole carboxylic acids and derivativesvinylogous amides |
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| Substituents | carbonyl groupcarboxylic acidindolecarboxylic acid derivativeketoneorganic oxidepyrrole-2-carboxylic acidpyrrole-2-carboxylic acid or derivativesaromatic heteropolycyclic compoundorganonitrogen compoundalpha-keto acidorganopnictogen compoundindolecarboxylic acid derivativevinylogous amideazacycleheteroaromatic compoundorganic oxygen compoundketo acidpyrroledicarboxylic acid or derivativeshydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compoundaryl ketone |
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