| Record Information |
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| HMDB Status | detected |
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| Creation Date | 2024-02-20 23:36:09 UTC |
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| Update Date | 2025-03-21 17:57:13 UTC |
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| HMDB ID | HMDB0257414 |
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| Metabolite Identification |
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| DeepMet ID | DMID00006458 |
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| Name | S-Nitroso-N-acetylcysteine |
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| Frequency | 799.3 |
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| Structure | |
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| Chemical Formula | C5H8N2O4S |
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| Molecular Mass | 192.0205 |
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| SMILES | CC(=O)NC(CSN=O)C(=O)O |
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| InChI Key | QTJKCQPXTOYYHJ-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 | n-acyl-alpha amino acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acetamidesalpha amino acidscarbonyl compoundscarboxylic acidscysteine and derivativeshydrocarbon derivativesmonocarboxylic acids and derivativesnitrosothiolsorganic oxidesorganopnictogen compoundssecondary carboxylic acid amidessulfenyl compounds |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidorganosulfur compoundnitrosothiolorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundacetamideorganic s-nitroso compoundorganic nitroso compoundsulfenyl compoundn-acyl-alpha-amino acidcarboxamide groupsecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundcysteine or derivativeshydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundnitrosothiol-group |
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