| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:06:43 UTC |
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| Update Date | 2025-03-21 18:29:34 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00078306 |
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| Frequency | 37.4 |
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| Structure | |
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| Chemical Formula | C8H10O4S |
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| Molecular Mass | 202.03 |
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| SMILES | Cc1cccc(O)c1OS(C)(=O)=O |
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| InChI Key | OUOFPAUMWVKQQT-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 | phenols |
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| Subclass | cresols |
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| Direct Parent | meta cresols |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidshydrocarbon derivativesmethanesulfonatesorganic oxidesorganooxygen compoundsorganosulfonic acid estersphenoxy compoundssulfonic acid esterssulfonylstoluenes |
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| Substituents | organosulfonic acid or derivativesmonocyclic benzene moietym-cresol1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidorganosulfur compoundorganosulfonic acid esteraromatic homomonocyclic compoundsulfonic acid estermethanesulfonateorganic oxidesulfonylorganic oxygen compoundorganic sulfonic acid or derivativeshydrocarbon derivativephenoxy compoundtolueneorganooxygen compound |
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