| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 12:12:57 UTC |
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| Update Date | 2025-03-24 21:32:08 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01808370 |
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| Frequency | 0.7 |
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| Structure | |
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| Chemical Formula | C7H5NO2 |
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| Molecular Mass | 135.032 |
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| SMILES | O=C(O)c1cccc2c1N2 |
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| InChI Key | YQRKWHFQXGXGRV-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | carboxylic acids |
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| Direct Parent | 1-carboxy-2-haloaromatic compounds |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | amino acidsazacyclic compoundsazepinesbenzenoidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundssecondary aminesvinylogous amides |
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| Substituents | vinylogous amideazacycleamino acid or derivativesamino acidsecondary amineorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundazepinearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoid1-carboxy-2-haloaromatic compoundorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compoundamine |
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