| Record Information |
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| HMDB Status | expected |
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| Creation Date | 2024-02-20 23:34:52 UTC |
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| Update Date | 2025-03-21 17:56:46 UTC |
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| HMDB ID | HMDB0028684 |
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| Metabolite Identification |
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| DeepMet ID | DMID00003530 |
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| Name | Alanylcysteine |
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| Frequency | 1677.7 |
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| Structure | |
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| Chemical Formula | C6H12N2O3S |
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| Molecular Mass | 192.0569 |
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| SMILES | CC(N)C(=O)NC(CS)C(=O)O |
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| InChI Key | JQDFGZKKXBEANU-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 | dipeptides |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alanine and derivativesalkylthiolsalpha amino acid amidesalpha amino acidscarbonyl compoundscarboxylic acidscysteine and derivativeshydrocarbon derivativesmonoalkylaminesmonocarboxylic acids and derivativesn-acyl-alpha amino acidsorganic oxidesorganonitrogen compoundsorganopnictogen compoundsorganosulfur compoundssecondary carboxylic acid amides |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidalpha-amino acid or derivativesorganosulfur compoundorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundn-acyl-alpha amino acid or derivativesalpha-amino acid amiden-acyl-alpha-amino acidcarboxamide groupalpha-dipeptidesecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundcysteine or derivativesalanine or derivativeshydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundalkylthiolorganooxygen compound |
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