| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:26:08 UTC |
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| Update Date | 2025-03-21 18:39:18 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00124966 |
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| Frequency | 20.6 |
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| Structure | |
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| Chemical Formula | C7H11NO3S |
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| Molecular Mass | 189.046 |
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| SMILES | CC(=O)N1CSCCC1C(=O)O |
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| InChI Key | IWBKVCCARWJRNV-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | amino acids, peptides, and analogues |
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| Direct Parent | alpha amino acids |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | acetamidesazacyclic compoundscarbonyl compoundscarboxylic acidsdialkylthioethershydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundstertiary carboxylic acid amidesthiazinanesthiohemiaminal derivatives |
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| Substituents | carbonyl groupcarboxylic acidazacycledialkylthioethercarboxamide grouporganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundthioethertertiary carboxylic acid amidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidhemithioaminalorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compound1,3-thiazinaneorganoheterocyclic compoundacetamideorganooxygen compound |
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