| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 03:56:10 UTC |
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| Update Date | 2025-03-21 23:01:00 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00618482 |
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| Frequency | 2.6 |
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| Structure | |
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| Chemical Formula | C6H8O2S |
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| Molecular Mass | 144.0245 |
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| SMILES | O=C(O)CC1=CCSC1 |
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| InChI Key | KTUUXFOSQITQSK-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | fatty acyls |
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| Subclass | fatty acids and conjugates |
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| Direct Parent | thia fatty acids |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidsdialkylthioethersdihydrothiophenesfatty acylshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
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| Substituents | carbonyl groupcarboxylic aciddialkylthioether2,5-dihydrothiophenecarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesthia fatty acidorganic oxygen compoundthioetheraliphatic heteromonocyclic compoundhydrocarbon derivativeorganoheterocyclic compoundorganooxygen compound |
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