| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:53:30 UTC |
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| Update Date | 2025-03-25 00:51:22 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02186477 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C4H6N2O3S |
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| Molecular Mass | 162.0099 |
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| SMILES | NC1=NC(O)(C(=O)O)CS1 |
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| InChI Key | RCYVBCGOYPIHOZ-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 | alkanolaminesalpha hydroxy acids and derivativesazacyclic compoundscarbonyl compoundscarboximidamidescarboxylic acidshydrocarbon derivativesisothioureasmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundsthiazolines |
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| Substituents | carbonyl groupcarboxylic acidmeta-thiazolinealpha-hydroxy acidpropargyl-type 1,3-dipolar organic compoundorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundalkanolamineisothioureaazacycleorganic 1,3-dipolar compoundcarboximidamidehydroxy acidmonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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