| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:01:55 UTC |
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| Update Date | 2025-03-21 18:07:02 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00066717 |
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| Frequency | 45.7 |
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| Structure | |
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| Chemical Formula | C6H15NO4S |
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| Molecular Mass | 197.0722 |
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| SMILES | CCN(CC)CCOS(=O)(=O)O |
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| InChI Key | LZJCTYGWKPKEGL-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | organic sulfuric acids and derivatives |
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| Subclass | sulfuric acid esters |
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| Direct Parent | sulfuric acid monoesters |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkyl sulfateshydrocarbon derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundstrialkylamines |
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| Substituents | aliphatic acyclic compoundsulfuric acid monoestertertiary aliphatic amineorganic oxideorganic oxygen compoundalkyl sulfateorganonitrogen compoundorganopnictogen compoundsulfate-esterhydrocarbon derivativeorganic nitrogen compoundaminetertiary amineorganooxygen compound |
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