| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:22:53 UTC |
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| Update Date | 2025-03-25 01:02:04 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02253632 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H10O5S |
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| Molecular Mass | 230.0249 |
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| SMILES | O=C(CS(=O)(=O)O)C(O)c1ccccc1 |
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| InChI Key | SMGXUNRZKPGXMZ-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 | benzene and substituted derivatives |
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| Direct Parent | benzene and substituted derivatives |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | acyloinsalpha-hydroxy ketonesaromatic alcoholshydrocarbon derivativesorganic oxidesorganosulfonic acidssecondary alcoholssulfonyls |
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| Substituents | aromatic alcoholalcoholorganosulfonic acid or derivativesmonocyclic benzene moietycarbonyl grouporganosulfonic acidorganosulfur compoundalpha-hydroxy ketoneketonearomatic homomonocyclic compoundorganic oxidesulfonylorganic oxygen compoundorganic sulfonic acid or derivativesacyloinsecondary alcoholhydrocarbon derivativeorganooxygen compound |
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