| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:56:34 UTC |
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| Update Date | 2025-03-25 00:52:23 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02193372 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H14O6S |
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| Molecular Mass | 238.0511 |
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| SMILES | CCCCC=CC(=O)OCOS(=O)(=O)O |
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| InChI Key | ZIKUEQCTSLCWTM-UHFFFAOYSA-N |
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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 acid esters |
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| Direct Parent | fatty acid esters |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkyl sulfatescarbonyl compoundsenoate estershydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidessulfuric acid monoesters |
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| Substituents | enoate esteraliphatic acyclic compoundcarbonyl groupsulfuric acid monoesterorganic sulfuric acid or derivativescarboxylic acid derivativealpha,beta-unsaturated carboxylic esterfatty acid esterorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esteralkyl sulfatesulfate-esterhydrocarbon derivativesulfuric acid esterorganooxygen compound |
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