Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:27:51 UTC |
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Update Date | 2025-03-21 18:40:13 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00129076 |
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Frequency | 19.7 |
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Structure | |
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Chemical Formula | C6H7NO3S |
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Molecular Mass | 173.0147 |
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SMILES | Nc1cccc(S(=O)O)c1O |
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InChI Key | LQRXKZODAFMWEZ-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 | 1-hydroxy-4-unsubstituted benzenoids |
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Direct Parent | 1-hydroxy-4-unsubstituted benzenoids |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | benzene and substituted derivativeshydrocarbon derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundsorganosulfur compoundsprimary aminessulfinic acids |
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Substituents | monocyclic benzene moietysulfinic acid derivative1-hydroxy-4-unsubstituted benzenoidorganosulfur compoundsulfinic acidaromatic homomonocyclic compoundorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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