| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:50:47 UTC |
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| Update Date | 2025-03-25 00:50:20 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02180304 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H9NO4 |
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| Molecular Mass | 183.0532 |
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| SMILES | Cc1cc(C(N)=O)c(O)c(O)c1O |
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| InChI Key | LPCCLUSKBKHFSG-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 | salicylamides |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-4-unsubstituted benzenoids5-unsubstituted pyrrogallolsbenzamidesbenzoyl derivativescarboxylic acids and derivativeshydrocarbon derivativesmeta cresolsorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsortho cresolspara cresolsprimary carboxylic acid amidesvinylogous acidsm-toluamides |
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| Substituents | primary carboxylic acid amidebenzoylcarboxylic acid derivativetoluamidebenzamideorganic oxide5-unsubstituted pyrrogallolp-cresolo-cresolorganonitrogen compoundorganopnictogen compoundpyrogallol derivativem-cresolm-toluamidebenzenetriol1-hydroxy-4-unsubstituted benzenoidcarboxamide groupsalicylamidearomatic homomonocyclic compoundvinylogous acidorganic oxygen compoundphenolhydrocarbon derivativeorganic nitrogen compoundtolueneorganooxygen compound |
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