Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:46:36 UTC |
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Update Date | 2025-03-21 18:00:59 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00030350 |
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Frequency | 122.6 |
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Structure | |
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Chemical Formula | C7H8O4S |
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Molecular Mass | 188.0143 |
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SMILES | Cc1cccc(O)c1OS(=O)O |
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InChI Key | VYZXUMRFCBULNQ-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 derivativesorganic oxidesorganooxygen compoundsphenoxy compoundstoluenes |
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Substituents | monocyclic benzene moietym-cresol1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidaromatic homomonocyclic compoundorganic oxideorganic oxygen compoundhydrocarbon derivativephenoxy compoundtolueneorganooxygen compound |
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