| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:48:58 UTC |
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| Update Date | 2025-03-25 00:49:43 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02176117 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H14N2O4S |
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| Molecular Mass | 210.0674 |
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| SMILES | NS(=O)(=O)CCCNCCC(=O)O |
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| InChI Key | BSAQPGYDAQZGRJ-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 | beta amino acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | amino acidsaminosulfonyl compoundscarbonyl compoundscarboxylic acidsdialkylamineshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganic sulfonamidesorganopnictogen compoundsorganosulfonamides |
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| Substituents | aliphatic acyclic compoundorganosulfonic acid or derivativescarbonyl groupcarboxylic acidamino acidorganosulfur compoundorganosulfonic acid amideorganic oxideorganonitrogen compoundorganopnictogen compoundsecondary aliphatic amineaminosulfonyl compoundsecondary aminebeta amino acid or derivativesmonocarboxylic acid or derivativessulfonylorganic oxygen compoundorganic sulfonic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundorganic sulfonic acid amideorganooxygen compoundamine |
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