| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:41:18 UTC |
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| Update Date | 2025-03-21 17:59:01 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00018202 |
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| Frequency | 228.3 |
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| Structure | |
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| Chemical Formula | C10H14O2S |
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| Molecular Mass | 198.0715 |
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| SMILES | OC(CS)C(O)Cc1ccccc1 |
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| InChI Key | IMYZZHTZUMNAEZ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | benzene and substituted derivatives |
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| Direct Parent | benzene and substituted derivatives |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1,2-diolsalkylthiolshydrocarbon derivativesorganosulfur compoundssecondary alcohols |
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| Substituents | alcoholaromatic homomonocyclic compoundmonocyclic benzene moietyorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganosulfur compoundalkylthiolorganooxygen compound1,2-diol |
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