| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 13:04:48 UTC |
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| Update Date | 2025-03-24 21:54:50 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01930901 |
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| Frequency | 0.6 |
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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 | O=C(CO)c1ccsc1 |
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| InChI Key | BMRRUBLEUWKRTR-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 | alcohols and polyolsheteroaromatic compoundshydrocarbon derivativesorganic oxidesthiophenes |
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| Substituents | alcoholaryl alkyl ketonearomatic heteromonocyclic compoundheteroaromatic compoundthiopheneorganic oxidehydrocarbon derivativeorganoheterocyclic compound |
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