| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:30:01 UTC |
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| Update Date | 2025-03-21 18:41:24 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00134092 |
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| Frequency | 18.8 |
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| Structure | |
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| Chemical Formula | C7H10N2O3S |
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| Molecular Mass | 202.0412 |
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| SMILES | O=C1NC2CSCC2C(C(=O)O)N1 |
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| InChI Key | SGTBBMKHDWNQAG-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 acidsdialkylthioethersdiazinaneshydrocarbon derivativesmonocarboxylic acids and derivativesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrimidonesthiolanes |
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| Substituents | thiolanecarbonyl groupcarbonic acid derivativecarboxylic acidazacycledialkylthioetherpyrimidonepyrimidinealiphatic heteropolycyclic compound1,3-diazinaneorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundthioetherorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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