| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:44:01 UTC |
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| Update Date | 2025-03-25 00:47:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02164778 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H14O7S |
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| Molecular Mass | 254.046 |
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| SMILES | CC(O)C1OS(=O)(=O)C(CCC(=O)O)C1O |
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| InChI Key | XQQQKAGUXBKFKP-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | oxathiolanes |
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| Subclass | gamma sultones |
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| Direct Parent | gamma sultones |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganosulfonic acid estersoxacyclic compoundssecondary alcoholssulfonic acid esters |
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| Substituents | alcoholorganosulfonic acid or derivativescarbonyl groupcarboxylic acidcarboxylic acid derivativeorganosulfonic acid estersulfonic acid esteroxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganic sulfonic acid or derivativesaliphatic heteromonocyclic compoundsecondary alcoholhydrocarbon derivativegamma-sultoneorganooxygen compound |
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