| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:52:59 UTC |
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| Update Date | 2025-03-25 00:51:11 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02185260 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H15N3O5S2 |
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| Molecular Mass | 297.0453 |
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| SMILES | NC(=O)C(N)CSSCC(=O)C(O)NCC(=O)O |
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| InChI Key | HRYQVBMOSMFKKU-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 | cysteine and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkanolaminesalpha amino acidsalpha-hydroxy ketonesamino acidscarboxylic acidsdialkylaminesdialkyldisulfideshydrocarbon derivativesmonoalkylaminesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesorganopnictogen compoundsprimary carboxylic acid amidessulfenyl compounds |
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| Substituents | primary carboxylic acid amidealiphatic acyclic compoundcarbonyl groupcarboxylic acidamino acidmonosaccharideorganosulfur compoundalpha-hydroxy ketoneketonesaccharideorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundalkanolaminesecondary aliphatic aminesulfenyl compoundsecondary aminecarboxamide groupdialkyldisulfidemonocarboxylic acid or derivativesorganic oxygen compoundorganic disulfidecysteine or derivativeshydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compoundamine |
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