| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:06:39 UTC |
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| Update Date | 2025-03-25 00:56:11 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02216712 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H8O3S |
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| Molecular Mass | 172.0194 |
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| SMILES | CCC1=C(C(=O)O)CSC1=O |
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| InChI Key | AVTDCVLBFDMOPS-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 oxidesthioestersthiolactones |
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| Substituents | carbothioic s-lactonethiocarboxylic acid or derivativescarbonyl groupcarboxylic acidthiocarboxylic acid ester2,5-dihydrothiophenecarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaliphatic heteromonocyclic compoundhydrocarbon derivativethiolactoneorganooxygen compound |
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