| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:09:07 UTC |
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| Update Date | 2025-03-25 00:57:04 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02222464 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C5H7N3O4S |
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| Molecular Mass | 205.0157 |
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| SMILES | O=C1NC2=NC(C(=O)O)C[SH]2(=O)N1 |
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| InChI Key | CZYKVBYGEOYUKX-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 heteropolycyclic compounds |
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| Alternative Parents | alkylthiolsazacyclic compoundscarbonyl compoundscarboximidamidescarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic carbonic acids and derivativesorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundsthiadiazolidinesthiazolines |
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| Substituents | carbonyl groupcarbonic acid derivativecarboxylic acidmeta-thiazolinethiadiazolidineazacycleorganic 1,3-dipolar compoundcarboximidamidepropargyl-type 1,3-dipolar organic compoundaliphatic heteropolycyclic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundalkylthiolorganoheterocyclic compoundorganooxygen compound |
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