| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:44:58 UTC |
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| Update Date | 2025-03-25 00:48:15 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02166996 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H6O2S |
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| Molecular Mass | 142.0088 |
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| SMILES | CC(=O)c1ccc(O)s1 |
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| InChI Key | XIVUEEJXOLUMLC-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | aryl alkyl ketones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2,5-disubstituted thiophenesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganooxygen compounds |
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| Substituents | 2,5-disubstituted thiophenearyl alkyl ketonearomatic heteromonocyclic compoundheteroaromatic compoundthiopheneorganic oxidehydrocarbon derivativeorganoheterocyclic compound |
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