| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:13:22 UTC |
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| Update Date | 2025-03-25 00:58:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02231823 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H16O5S |
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| Molecular Mass | 248.0718 |
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| SMILES | CC12CCC(OS(=O)(=O)O)CC1CCC2=O |
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| InChI Key | KOHQOQQIJLCMCS-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 homopolycyclic compounds |
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| Alternative Parents | alkyl sulfateshydrocarbon derivativesketonesorganic oxides |
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| Substituents | sulfuric acid monoestercarbonyl groupaliphatic homopolycyclic compoundketoneorganic oxideorganic oxygen compoundalkyl sulfatesulfate-esterhydrocarbon derivativeorganooxygen compound |
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