| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 01:20:20 UTC |
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| Update Date | 2025-03-21 19:11:45 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00251613 |
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| Frequency | 8.3 |
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| Structure | |
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| Chemical Formula | C6H6OS |
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| Molecular Mass | 126.0139 |
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| SMILES | C=C1C=C(C)C(=O)S1 |
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| InChI Key | NYCCDCJRZINVDO-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 acids and derivativeshydrocarbon derivativesorganic oxidesthioestersthiolactones |
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| Substituents | carbothioic s-lactonethiocarboxylic acid or derivativescarbonyl groupthiocarboxylic acid ester2,5-dihydrothiophenecarboxylic acid derivativeorganic oxideorganic oxygen compoundaliphatic heteromonocyclic compoundhydrocarbon derivativethiolactoneorganooxygen compound |
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