| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:44:26 UTC |
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| Update Date | 2025-03-25 00:48:02 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02165730 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H16N2O4S |
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| Molecular Mass | 260.0831 |
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| SMILES | CC=CCCCC(O)=NC(CSN=O)C(=O)O |
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| InChI Key | ZLXUWYLQHDNKEO-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 | cysteine and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha amino acidscarbonyl compoundscarboximidic acidscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesnitrosothiolsorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundssulfenyl compounds |
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| Substituents | aliphatic acyclic compoundcarboximidic acidcarbonyl groupcarboxylic acidorganosulfur compoundnitrosothiolpropargyl-type 1,3-dipolar organic compoundorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganic s-nitroso compoundorganic nitroso compoundsulfenyl compoundorganic 1,3-dipolar compoundmonocarboxylic acid or derivativesorganic oxygen compoundcysteine or derivativeshydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundnitrosothiol-group |
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