| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 12:02:03 UTC |
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| Update Date | 2025-03-24 21:26:58 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01782028 |
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| Frequency | 0.7 |
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| Structure | |
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| Chemical Formula | C5H8N2OS |
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| Molecular Mass | 144.0357 |
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| SMILES | O=C1NCC2CSNC12 |
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| InChI Key | VFNOPPVFYLVXLE-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 compoundscarboxylic acids and derivativeshydrocarbon derivativeslactamsorganic oxidesorganonitrogen compoundsorganopnictogen compoundsorganosulfenic acid amidespyrrolidine-2-onessecondary carboxylic acid amides |
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| Substituents | 2-pyrrolidonecarbonyl grouporganosulfenic acid amidelactamazacyclecarboxamide groupaliphatic heteropolycyclic compoundsecondary carboxylic acid amideorganic oxideorganic oxygen compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundpyrrolidinepyrrolidoneorganoheterocyclic compoundorganooxygen compound |
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