| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:47:48 UTC |
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| Update Date | 2025-03-25 00:49:19 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02173433 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H16O3S |
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| Molecular Mass | 192.082 |
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| SMILES | CCC(O)CCSCCC(=O)O |
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| InChI Key | YMBWREOUPWKZGY-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | alcohols and polyols |
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| Direct Parent | secondary alcohols |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidsdialkylthioethershydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidessulfenyl compounds |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidsulfenyl compounddialkylthioetherorganosulfur compoundcarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesthioethersecondary alcoholhydrocarbon derivative |
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