| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:45:19 UTC |
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| Update Date | 2025-03-21 18:00:27 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00027418 |
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| Frequency | 138.4 |
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| Structure | |
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| Chemical Formula | C13H21NO2S |
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| Molecular Mass | 255.1293 |
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| SMILES | CCCN(CCC)S(=O)(=O)c1ccccc1C |
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| InChI Key | LSDVBQXFLHEXKK-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 | benzenesulfonamides |
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| Direct Parent | benzenesulfonamides |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | aminosulfonyl compoundsbenzenesulfonyl compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsorganosulfonamidestoluenes |
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| Substituents | organosulfonic acid or derivativesbenzenesulfonamideaminosulfonyl compoundorganosulfur compoundorganosulfonic acid amidearomatic homomonocyclic compoundorganic oxidesulfonylorganic oxygen compoundorganic sulfonic acid or derivativesorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundtoluenebenzenesulfonyl group |
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