| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:17:17 UTC |
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| Update Date | 2025-03-21 18:35:03 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00103671 |
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| Frequency | 26.2 |
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| Structure | |
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| Chemical Formula | C8H8O3S |
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| Molecular Mass | 184.0194 |
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| SMILES | CSc1cccc(C(=O)O)c1O |
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| InChI Key | TZRMFKCHBWZNIF-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 | m-sulfanylbenzoic acids |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-carboxy-2-haloaromatic compounds1-hydroxy-4-unsubstituted benzenoidsalkylarylthioethersbenzoic acidsbenzoyl derivativeshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganooxygen compoundssalicylic acidssulfenyl compoundsthiophenol ethersthiophenolsvinylogous acids |
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| Substituents | carboxylic acidbenzoylsalicylic acidalkylarylthioetherorganosulfur compoundcarboxylic acid derivativearyl thioetherorganic oxidethiophenolthiophenol ether1-carboxy-2-haloaromatic compoundbenzoic acidm-sulfanylbenzoic acidsulfenyl compound1-hydroxy-4-unsubstituted benzenoidhydroxybenzoic acidaromatic homomonocyclic compoundvinylogous acidmonocarboxylic acid or derivativesorganic oxygen compoundsalicylic acid or derivativesthioetherphenolhydrocarbon derivativeorganooxygen compound |
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