| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:05:34 UTC |
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| Update Date | 2025-03-25 00:55:47 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02214224 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H10OS |
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| Molecular Mass | 154.0452 |
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| SMILES | CCc1cc(C(C)=O)cs1 |
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| InChI Key | MISPBLJCWHZBBA-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 | heteroaromatic compoundshydrocarbon derivativesorganic oxidesorganooxygen compoundsthiophenes |
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| Substituents | organic oxidearyl alkyl ketonearomatic heteromonocyclic compoundheteroaromatic compoundhydrocarbon derivativethiopheneorganoheterocyclic compound |
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