Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:50:26 UTC |
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Update Date | 2025-03-21 18:02:41 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00039555 |
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Frequency | 87.9 |
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Structure | |
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Chemical Formula | C8H8O5 |
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Molecular Mass | 184.0372 |
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SMILES | Cc1c(O)cc(O)c(C(=O)O)c1O |
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InChI Key | KUZMGSVKYDYRHJ-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 | salicylic acids |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | 1-carboxy-2-haloaromatic compounds1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsbenzoic acidsbenzoyl derivativeshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganooxygen compoundsortho cresolspara cresolsphloroglucinols and derivativestoluenesvinylogous acids |
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Substituents | carboxylic acidbenzoyl1-hydroxy-2-unsubstituted benzenoidsalicylic acidcarboxylic acid derivativephloroglucinol derivativeorganic oxidep-cresolo-cresol1-carboxy-2-haloaromatic compoundbenzoic acidbenzenetriol1-hydroxy-4-unsubstituted benzenoidaromatic homomonocyclic compoundvinylogous acidmonocarboxylic acid or derivativesorganic oxygen compoundphenolhydrocarbon derivativetolueneorganooxygen compound |
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