| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:51:26 UTC |
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| Update Date | 2025-03-25 00:50:34 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02181793 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C5H4O4S |
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| Molecular Mass | 159.983 |
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| SMILES | O=C(O)C1=CC(O)C(=O)S1 |
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| InChI Key | NQWFHQYSNZAUPI-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 | carbonyl compoundscarbothioic s-lactonescarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidessecondary alcoholsthioestersthiolactones |
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| Substituents | carbothioic s-lactonealcoholthiocarboxylic acid or derivativescarbonyl groupcarboxylic acid2,3-dihydrothiophenethiocarboxylic acid estercarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaliphatic heteromonocyclic compoundsecondary alcoholhydrocarbon derivativethiolactoneorganooxygen compound |
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