| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:32:07 UTC |
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| Update Date | 2025-03-21 18:42:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00138928 |
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| Frequency | 17.9 |
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| Structure | |
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| Chemical Formula | C5H8O2S |
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| Molecular Mass | 132.0245 |
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| SMILES | O=C1CCC(O)CS1 |
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| InChI Key | VDJNAHJXEMYQQZ-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 | thianes |
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| Subclass | thianes |
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| Direct Parent | thianes |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | carbonyl compoundscarbothioic s-lactonescarboxylic acids and derivativeshydrocarbon derivativesorganic oxidessecondary alcoholsthioestersthiolactones |
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| Substituents | carbothioic s-lactonealcoholthiocarboxylic acid or derivativescarbonyl groupthiocarboxylic acid estercarboxylic acid derivativeorganic oxideorganic oxygen compoundaliphatic heteromonocyclic compoundsecondary alcoholhydrocarbon derivativethiolactoneorganooxygen compoundthiane |
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