| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:12:15 UTC |
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| Update Date | 2025-03-21 18:32:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00091394 |
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| Frequency | 30.7 |
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| Structure | |
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| Chemical Formula | C8H7NO5S |
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| Molecular Mass | 229.0045 |
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| SMILES | COc1ccc2c(c1)OS(=O)(=O)C(=O)N2 |
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| InChI Key | LIWZTZHEJMHEBN-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 | phenol ethers |
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| Subclass | anisoles |
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| Direct Parent | anisoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkyl aryl ethersazacyclic compoundscarbonyl compoundshydrocarbon derivativesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundssulfonic acid estersthiolactones |
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| Substituents | carbonyl groupethercarbonic acid derivativeazacyclealkyl aryl ethersulfonic acid esteroxacycleorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundorganic sulfonic acid or derivativesanisoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundthiolactoneorganoheterocyclic compoundorganooxygen compound |
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