| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:11:26 UTC |
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| Update Date | 2025-03-25 00:57:55 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02227549 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H10O3S |
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| Molecular Mass | 174.0351 |
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| SMILES | CC(=O)CSC1CCC(=O)O1 |
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| InChI Key | XHCNUTHXLVOZJV-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 | lactones |
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| Subclass | gamma butyrolactones |
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| Direct Parent | gamma butyrolactones |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | carboxylic acid estershydrocarbon derivativesketonesmonocarboxylic acids and derivativesmonothioacetalsorganic oxidesoxacyclic compoundssulfenyl compoundstetrahydrofurans |
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| Substituents | carbonyl groupsulfenyl compoundtetrahydrofuranorganosulfur compoundcarboxylic acid derivativegamma butyrolactoneketonemonothioacetaloxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esteraliphatic heteromonocyclic compoundhydrocarbon derivativeorganooxygen compound |
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