| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:40:13 UTC |
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| Update Date | 2025-03-25 00:46:37 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02156288 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H6O3S |
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| Molecular Mass | 158.0038 |
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| SMILES | CC(=O)C1=C(O)CSC1=O |
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| InChI Key | DCSFFWNSNMDVRY-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 | dihydrothiophenes |
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| Subclass | dihydrothiophenes |
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| Direct Parent | dihydrothiophenes |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | carbothioic s-lactonescarboxylic acids and derivativeshydrocarbon derivativesketonesorganic oxidesthioestersthiolactonesvinylogous acids |
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| Substituents | carbothioic s-lactonethiocarboxylic acid or derivativescarbonyl groupthiocarboxylic acid ester2,5-dihydrothiophenecarboxylic acid derivativeketonevinylogous acidorganic oxideorganic oxygen compoundaliphatic heteromonocyclic compoundhydrocarbon derivativethiolactoneorganooxygen compound |
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