| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:04:48 UTC |
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| Update Date | 2025-03-25 00:55:28 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02212488 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C19H36O6S |
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| Molecular Mass | 392.2233 |
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| SMILES | CCCCCCCCCCCCCCCC(=O)CCC(=O)OS(=O)(=O)O |
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| InChI Key | WDITUYMVQZRMQD-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 | keto acids and derivatives |
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| Subclass | gamma-keto acids and derivatives |
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| Direct Parent | gamma-keto acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | hydrocarbon derivativesketonesmonocarboxylic acids and derivativesorganic oxidessulfuric acid monoesters |
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| Substituents | aliphatic acyclic compoundsulfuric acid monoestercarbonyl grouporganic sulfuric acid or derivativescarboxylic acid derivativegamma-keto acidketoneorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativesulfuric acid esterorganooxygen compound |
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