Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:42:00 UTC |
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Update Date | 2025-03-21 17:59:15 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00019771 |
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Frequency | 206.0 |
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Structure | |
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Chemical Formula | C7H8O3S |
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Molecular Mass | 172.0194 |
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SMILES | O=S(=O)(O)Cc1ccccc1 |
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InChI Key | NIXKBAZVOQAHGC-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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