| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 09:33:25 UTC |
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| Update Date | 2025-03-24 20:22:28 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01427441 |
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| Frequency | 0.9 |
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| Structure | |
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| Chemical Formula | C4H5NO2S |
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| Molecular Mass | 131.0041 |
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| SMILES | O=C(CO)CN=C=S |
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| InChI Key | AGSNWPFXLXMNPS-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 | alpha-hydroxy ketones |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alcohols and polyolshydrocarbon derivativesisothiocyanatesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | alcoholaliphatic acyclic compoundisothiocyanateorganic 1,3-dipolar compoundorganosulfur compoundalpha-hydroxy ketonepropargyl-type 1,3-dipolar organic compoundorganic oxideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compound |
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