| 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 | DMID02186472 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H11NO3S |
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| Molecular Mass | 189.046 |
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| SMILES | NC1C(=O)SCC1CCC(=O)O |
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| InChI Key | WMUHXHQUUUNOQU-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 | delta amino acids and derivatives |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acidscarbonyl compoundscarbothioic s-lactonescarboxylic acidshydrocarbon derivativesmonoalkylaminesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsthioestersthiolactonesthiolanes |
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| Substituents | thiolanecarbothioic s-lactonethiocarboxylic acid or derivativescarbonyl groupcarboxylic acidthiocarboxylic acid esteralpha-amino acid or derivativesorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compounddelta amino acid or derivativeshydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundthiolactoneorganoheterocyclic compoundorganooxygen compound |
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