| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 10:55:46 UTC |
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| Update Date | 2025-03-24 20:57:18 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01623340 |
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| Frequency | 0.8 |
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| Structure | |
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| Chemical Formula | C5H7NO2S |
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| Molecular Mass | 145.0197 |
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| SMILES | O=C(CO)CCN=C=S |
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| InChI Key | GSNDSCYGODZWKB-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 | carbohydrates and carbohydrate conjugates |
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| Direct Parent | monosaccharides |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alcohols and polyolsalpha-hydroxy ketoneshydrocarbon derivativesisothiocyanatesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | alcoholaliphatic acyclic compoundisothiocyanatecarbonyl groupmonosaccharideorganic 1,3-dipolar compoundorganosulfur compoundalpha-hydroxy ketonepropargyl-type 1,3-dipolar organic compoundketoneorganic oxideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compound |
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