| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:39:10 UTC |
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| Update Date | 2025-03-25 00:46:12 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02153894 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H19NO3S |
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| Molecular Mass | 221.1086 |
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| SMILES | CS(=O)CCCNCCCCC(=O)O |
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| InChI Key | LUKQZLFSRGCRNC-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 | delta amino acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | amino acidscarbonyl compoundscarboxylic acidsdialkylamineshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundsstraight chain fatty acidssulfinyl compoundssulfoxides |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidamino acidfatty acidorganosulfur compoundorganic oxidesulfinyl compoundorganonitrogen compoundorganopnictogen compounddelta amino acid or derivativessecondary aliphatic aminestraight chain fatty acidsecondary aminemonocarboxylic acid or derivativesorganic oxygen compoundsulfoxidehydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
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