| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:38:47 UTC |
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| Update Date | 2025-03-25 00:46:03 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02152964 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H6FNO3 |
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| Molecular Mass | 171.0332 |
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| SMILES | NC(=O)c1ccc(O)c(O)c1F |
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| InChI Key | UCDFHMRPMAHAMT-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 | 2-halobenzoic acids and derivatives |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsaryl fluoridesbenzamidesbenzoyl derivativescarboxylic acids and derivativesfluorobenzeneshalophenolshydrocarbon derivativesm-fluorophenolso-fluorophenolsorganic oxidesorganofluoridesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsprimary carboxylic acid amidesvinylogous halides |
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| Substituents | aryl fluorideprimary carboxylic acid amidebenzoyl1-hydroxy-2-unsubstituted benzenoidcarboxylic acid derivativeorganohalogen compoundbenzamidefluorobenzeneorganic oxideorganonitrogen compoundorganopnictogen compound3-halophenolorganofluoride1-hydroxy-4-unsubstituted benzenoidcarboxamide groupvinylogous halide3-fluorophenol2-fluorophenol2-halobenzoic acid or derivativesaryl halidearomatic homomonocyclic compound2-halophenolorganic oxygen compoundphenolhydrocarbon derivativeorganic nitrogen compoundhalobenzeneorganooxygen compound |
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