| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:11:08 UTC |
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| Update Date | 2025-03-21 18:32:00 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00088720 |
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| Frequency | 31.9 |
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| Structure | |
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| Chemical Formula | C8H8O4S |
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| Molecular Mass | 200.0143 |
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| SMILES | O=C(O)Cc1cccc(S(=O)O)c1 |
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| InChI Key | MTYMFDYTLIZQDI-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 | carbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganosulfur compoundssulfinic acids |
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| Substituents | monocyclic benzene moietycarbonyl groupcarboxylic acidsulfinic acid derivativeorganosulfur compoundcarboxylic acid derivativesulfinic acidaromatic homomonocyclic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganooxygen compound |
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