| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 11:39:12 UTC |
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| Update Date | 2025-03-24 21:16:45 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01728402 |
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| Frequency | 0.7 |
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| Structure | |
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| Chemical Formula | C5H3NO4 |
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| Molecular Mass | 141.0062 |
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| SMILES | O=Cc1cc(C(=O)O)no1 |
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| InChI Key | OKWIVAGIAIZCSZ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | aryl-aldehydes |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativesisoxazolesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsoxacyclic compounds |
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| Substituents | carboxylic acidaromatic heteromonocyclic compoundazacycleheteroaromatic compoundisoxazolecarboxylic acid derivativeoxacycleorganic oxidemonocarboxylic acid or derivativesaryl-aldehydeorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundazole |
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