| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:07:19 UTC |
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| Update Date | 2025-03-25 00:56:25 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02218257 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H5NO2S |
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| Molecular Mass | 155.0041 |
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| SMILES | Cc1ncsc1C(=O)C=O |
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| InChI Key | LZLHEMIDUSGDHH-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 | 4,5-disubstituted thiazolesalpha ketoaldehydesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | aromatic heteromonocyclic compoundazacycleheteroaromatic compoundaldehyde4,5-disubstituted 1,3-thiazoleorganic oxideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundthiazolealpha-ketoaldehydeorganoheterocyclic compoundaryl ketoneazole |
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