| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:46:57 UTC |
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| Update Date | 2025-03-25 00:49:02 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02171482 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H12N2O5S |
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| Molecular Mass | 236.0467 |
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| SMILES | CN(C=O)C(SCC(N)C(=O)O)C(=O)O |
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| InChI Key | BIBBEDJGUHHYPT-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 | n-formyl-alpha amino acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha amino acidscarbonyl compoundscarboxylic acidscysteine and derivativesdialkylthioethersdicarboxylic acids and derivativeshydrocarbon derivativesmonoalkylaminesn,s-acetalsorganic oxidesorganonitrogen compoundsorganopnictogen compoundssulfenyl compoundstertiary carboxylic acid amides |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidorganosulfur compoundn,s-acetalorganic oxidetertiary carboxylic acid amideorganonitrogen compoundalpha-amino acidhemithioaminalorganopnictogen compoundsulfenyl compounddialkylthioethercarboxamide grouporganic oxygen compoundn-formyl-alpha-amino acidthioethercysteine or derivativesdicarboxylic acid or derivativeshydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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