| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:59:58 UTC |
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| Update Date | 2025-03-25 00:53:40 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02201223 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H14O2S |
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| Molecular Mass | 210.0715 |
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| SMILES | COc1ccc(C(C)C(=O)SC)cc1 |
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| InChI Key | NUENOIGZLKUIDB-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 | phenol ethers |
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| Subclass | anisoles |
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| Direct Parent | anisoles |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alkyl aryl etherscarbonyl compoundscarbothioic s-esterscarboxylic acids and derivativeshydrocarbon derivativesmethoxybenzenesorganic oxidesphenoxy compoundssulfenyl compoundsthioestersthiolactones |
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| Substituents | monocyclic benzene moietythiocarboxylic acid or derivativescarbonyl groupethersulfenyl compoundthiocarboxylic acid esteralkyl aryl etherorganosulfur compoundcarboxylic acid derivativemethoxybenzenecarbothioic s-esteraromatic homomonocyclic compoundorganic oxideorganic oxygen compoundanisolehydrocarbon derivativephenoxy compoundthiolactoneorganooxygen compound |
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