| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:47:49 UTC |
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| Update Date | 2025-03-21 18:01:30 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00033291 |
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| Frequency | 109.1 |
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| Structure | |
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| Chemical Formula | C5H6N2O2S |
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| Molecular Mass | 158.015 |
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| SMILES | O=C1NC2CSC(=O)C2N1 |
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| InChI Key | AVNVFKLQLHPRDZ-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 | azacyclic compoundscarbonyl compoundscarbothioic s-lactonescarboxylic acids and derivativeshydrocarbon derivativesimidazolidinonesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsthienoimidazolidinesthioestersthiolactonesthiolanesthiophenes |
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| Substituents | thiolaneimidazolidinecarbonyl groupthiophenealiphatic heteropolycyclic compoundimidazolidinoneorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundthiolactoneorganoheterocyclic compoundcarbothioic s-lactonethiocarboxylic acid or derivativescarbonic acid derivativeazacyclethiocarboxylic acid esterthienoimidazolidineorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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