| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:49:31 UTC |
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| Update Date | 2025-03-25 00:49:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02177443 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H15NO2S |
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| Molecular Mass | 213.0824 |
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| SMILES | Cc1ccc(S(=O)(=O)CCN)cc1C |
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| InChI Key | WEWIKRMWDKXZKH-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 | benzenesulfonyl compounds |
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| Direct Parent | benzenesulfonyl compounds |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | hydrocarbon derivativesmonoalkylaminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssulfoneso-xylenes |
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| Substituents | organosulfur compoundaromatic homomonocyclic compoundxyleneorganic oxideo-xylenesulfonylorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundsulfonebenzenesulfonyl group |
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