| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:02:00 UTC |
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| Update Date | 2025-03-21 18:07:03 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00066905 |
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| Frequency | 45.5 |
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| Structure | |
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| Chemical Formula | C9H12O3S |
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| Molecular Mass | 200.0507 |
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| SMILES | O=S(=O)(O)CCCc1ccccc1 |
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| InChI Key | FERGWWFGBNJVCP-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 | hydrocarbon derivativesorganic oxidesorganosulfonic acidssulfonyls |
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| Substituents | aromatic homomonocyclic compoundorganosulfonic acid or derivativesmonocyclic benzene moietyorganic oxidesulfonylorganic oxygen compoundorganic sulfonic acid or derivativesorganosulfonic acidhydrocarbon derivativeorganosulfur compound |
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