| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:50:40 UTC |
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| Update Date | 2025-03-21 18:02:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00040120 |
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| Frequency | 86.3 |
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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 | Cc1cc(C(=O)O)c(O)c(O)c1O |
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| InChI Key | GMGXJPGFYMKBEH-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-4-unsubstituted benzenoids5-unsubstituted pyrrogallolsbenzoic acidsbenzoyl derivativeshydrocarbon derivativesmeta cresolsmonocarboxylic acids and derivativesorganic oxidesorganooxygen compoundsortho cresolspara cresolstoluenesvinylogous acids |
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| Substituents | carboxylic acidbenzoylsalicylic acidcarboxylic acid derivativeorganic oxide5-unsubstituted pyrrogallolp-cresolo-cresol1-carboxy-2-haloaromatic compoundbenzoic acidpyrogallol derivativem-cresolbenzenetriol1-hydroxy-4-unsubstituted benzenoidaromatic homomonocyclic compoundvinylogous acidmonocarboxylic acid or derivativesorganic oxygen compoundphenolhydrocarbon derivativetolueneorganooxygen compound |
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