| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:30:37 UTC |
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| Update Date | 2025-03-21 18:41:39 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00135428 |
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| Frequency | 18.5 |
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| Structure | |
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| Chemical Formula | C7H16NO6S+ |
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| Molecular Mass | 242.0693 |
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| SMILES | C[N+](C)(C)C(CCC(=O)O)OS(=O)(=O)O |
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| InChI Key | SVSAPMHMONVGRF-UHFFFAOYSA-O |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | fatty acyls |
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| Subclass | fatty acids and conjugates |
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| Direct Parent | sulfated fatty acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkyl sulfatescarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic cationsorganic oxidesorganic saltsorganonitrogen compoundsorganopnictogen compoundsshort-chain hydroxy acids and derivativesstraight chain fatty acidssulfuric acid monoesterstetraalkylammonium salts |
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| Substituents | aliphatic acyclic compoundsulfuric acid monoestercarbonyl groupcarboxylic acidshort-chain hydroxy acidcarboxylic acid derivativeorganic oxidealkyl sulfateorganonitrogen compoundorganopnictogen compoundorganic cationorganic saltstraight chain fatty acidorganic sulfuric acid or derivativestetraalkylammonium saltmonocarboxylic acid or derivativesorganic oxygen compoundsulfated fatty acidsulfate-esterhydrocarbon derivativeorganic nitrogen compoundsulfuric acid esterorganooxygen compound |
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