| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 02:20:18 UTC |
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| Update Date | 2025-03-21 20:53:12 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00391039 |
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| Frequency | 4.7 |
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| Structure | |
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| Chemical Formula | C7H6OS |
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| Molecular Mass | 138.0139 |
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| SMILES | C=CC(=O)c1cccs1 |
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| InChI Key | NNRUYUFRXMHMCU-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 ketones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alpha,beta-unsaturated ketonesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganooxygen compoundsthiophenes |
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| Substituents | organic oxidearomatic heteromonocyclic compoundheteroaromatic compoundhydrocarbon derivativethiophenealpha,beta-unsaturated ketoneorganoheterocyclic compoundaryl ketone |
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