| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:16:33 UTC |
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| Update Date | 2025-03-25 00:59:45 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02239051 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C5H10N2O4S |
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| Molecular Mass | 194.0361 |
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| SMILES | NC(CC(=O)CS(N)=O)C(=O)O |
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| InChI Key | XLQCEZKBTBPLGW-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 acyclic compounds |
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| Alternative Parents | aminosulfinyl compoundscarboxylic acidsgamma-keto acids and derivativeshydrocarbon derivativesketonesmonoalkylaminesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsshort-chain keto acids and derivativessulfinic acid amides |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidsulfinic acid derivativeshort-chain keto acidsulfinic acid amideorganosulfur compoundketoneorganic oxidesulfinyl compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundgamma-keto acidaminosulfinyl compoundmonocarboxylic acid or derivativesorganic oxygen compoundketo acidhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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