| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:54:34 UTC |
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| Update Date | 2025-03-25 00:51:43 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02188910 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H12O2S |
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| Molecular Mass | 160.0558 |
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| SMILES | CC(O)CCC=CC(O)=S |
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| InChI Key | FRROZJZHWSOLMK-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 | carbodithioic acidscarbonyl compoundscarbothioic o-acidshydrocarbon derivativesthiocarbonyl compoundsthiocarboxylic acids and derivatives |
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| Substituents | aliphatic acyclic compoundthiocarboxylic acid or derivativescarbonyl groupthiocarbonyl groupcarbodithioic acidorganosulfur compoundcarbothioic o-acidsecondary alcoholhydrocarbon derivative |
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