| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:01:58 UTC |
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| Update Date | 2025-03-21 18:07:03 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00066855 |
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| Frequency | 45.6 |
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| Structure | |
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| Chemical Formula | C9H10O4 |
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| Molecular Mass | 182.0579 |
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| SMILES | Cc1cc(C(=O)O)c(O)c(C)c1O |
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| InChI Key | DGSVFCYEUDKSOR-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 compoundsbenzoic acidsbenzoyl derivativeshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganooxygen compoundsortho cresolspara cresolsphenolsresorcinolsvinylogous acidsm-xylenes |
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| Substituents | carboxylic acidbenzoylsalicylic acidcarboxylic acid derivativeresorcinolxyleneorganic oxidep-cresolo-cresol1-carboxy-2-haloaromatic compoundbenzoic acidm-xylenearomatic homomonocyclic compoundvinylogous acidmonocarboxylic acid or derivativesorganic oxygen compoundphenolhydrocarbon derivativeorganooxygen compound |
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