| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:05:13 UTC |
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| Update Date | 2025-03-25 00:55:39 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02213464 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H15NO3S |
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| Molecular Mass | 229.0773 |
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| SMILES | CN(C)Cc1ccc(OS(C)(=O)=O)cc1 |
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| InChI Key | WKGXRHQHRREDGE-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 | phenylmethylamines |
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| Direct Parent | phenylmethylamines |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | aralkylaminesbenzylamineshydrocarbon derivativesmethanesulfonatesorganic oxidesorganooxygen compoundsorganopnictogen compoundsorganosulfonic acid estersphenoxy compoundssulfonic acid esterssulfonylstrialkylamines |
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| Substituents | organosulfonic acid or derivativesorganosulfur compoundaralkylaminesulfonic acid esterorganic oxideorganonitrogen compoundorganopnictogen compoundtertiary aminetertiary aliphatic amineorganosulfonic acid esteraromatic homomonocyclic compoundmethanesulfonatephenylmethylaminesulfonylorganic oxygen compoundorganic sulfonic acid or derivativesbenzylaminehydrocarbon derivativeorganic nitrogen compoundphenoxy compoundamineorganooxygen compound |
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