| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:08:12 UTC |
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| Update Date | 2025-03-21 18:30:19 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00081872 |
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| Frequency | 35.3 |
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| Structure | |
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| Chemical Formula | C6H10N2O3S |
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| Molecular Mass | 190.0412 |
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| SMILES | NC(=O)C1CSCC(C(=O)O)N1 |
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| InChI Key | DVORIDOEHWRWJQ-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 heteromonocyclic compounds |
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| Alternative Parents | amino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsdialkylaminesdialkylthioethershydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundsprimary carboxylic acid amidesthiomorpholine carboxylic acids and derivatives |
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| Substituents | primary carboxylic acid amidecarbonyl groupcarboxylic acidamino acidorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundthiomorpholine-3-carboxylic acidorganoheterocyclic compound1,4-thiazinanesecondary aliphatic amineazacycledialkylthioethersecondary aminecarboxamide groupmonocarboxylic acid or derivativesorganic oxygen compoundthioetherhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
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