| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:04 UTC |
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| Update Date | 2025-03-25 00:46:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02158140 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H11N3O4S |
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| Molecular Mass | 257.047 |
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| SMILES | O=C(O)CNC(=O)C1=CC2NC(=O)NC2SC1 |
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| InChI Key | BDAFFOMXXLZKQS-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 | acyl glycines |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | alpha amino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsdialkylthioethershydrocarbon derivativesimidazolidinonesmonocarboxylic acids and derivativesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amidesthiohemiaminal derivativesthiopyrans |
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| Substituents | imidazolidinecarbonyl groupcarboxylic acidaliphatic heteropolycyclic compoundimidazolidinoneorganic oxideorganonitrogen compoundalpha-amino acidhemithioaminalorganopnictogen compoundorganoheterocyclic compoundcarbonic acid derivativeazacycledialkylthioethercarboxamide groupthiopyrann-acylglycinesecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundthioetherhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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