| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:55:15 UTC |
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| Update Date | 2025-03-25 00:51:57 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02190476 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H9NO3S |
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| Molecular Mass | 187.0303 |
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| SMILES | CC(=O)C1=CNC(C(=O)O)CS1 |
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| InChI Key | MYAVIJMJQXRXTJ-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 | 1,4-thiazinesamino acidsazacyclic compoundscarboxylic acidsdialkylamineshydrocarbon derivativesketonesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundsthioenol ethersvinylogous amides |
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| Substituents | carbonyl groupcarboxylic acidamino acidketoneorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundvinylogous amidesecondary aliphatic aminepara-thiazineazacyclesecondary aminemonocarboxylic acid or derivativesthioenoletherorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
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