| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 06:48:58 UTC |
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| Update Date | 2025-03-24 17:58:57 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01031733 |
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| Frequency | 1.4 |
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| Structure | |
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| Chemical Formula | C6H8O2S |
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| Molecular Mass | 144.0245 |
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| SMILES | O=C1CCCSC(=O)C1 |
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| InChI Key | HTJVWEMEVLAYSK-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 | thiepanes |
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| Subclass | thiepanes |
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| Direct Parent | thiepanes |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | carbothioic s-lactonescarboxylic acids and derivativescyclic ketoneshydrocarbon derivativesorganic oxidesthioestersthiolactones |
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| Substituents | carbothioic s-lactonethiocarboxylic acid or derivativescarbonyl groupthiocarboxylic acid estercyclic ketonecarboxylic acid derivativeketoneorganic oxideorganic oxygen compoundaliphatic heteromonocyclic compoundthiepanehydrocarbon derivativethiolactoneorganooxygen compound |
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