| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:42:37 UTC |
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| Update Date | 2025-03-25 00:47:25 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02161551 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H18N2O2S2 |
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| Molecular Mass | 238.081 |
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| SMILES | NCCSSCCNCCCC(=O)O |
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| InChI Key | LRLDFFZLCPYTPJ-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 | gamma amino acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | amino acidscarbonyl compoundscarboxylic acidsdialkylaminesdialkyldisulfideshydrocarbon derivativesmonoalkylaminesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundsstraight chain fatty acidssulfenyl compounds |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidamino acidgamma amino acid or derivativesfatty acidorganosulfur compoundorganic oxideorganonitrogen compoundorganopnictogen compoundsecondary aliphatic aminestraight chain fatty acidsulfenyl compoundsecondary aminedialkyldisulfidemonocarboxylic acid or derivativesorganic oxygen compoundorganic disulfidehydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compoundamine |
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