Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:37:42 UTC |
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Update Date | 2025-03-25 00:45:39 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02150446 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C26H50N4O5S2 |
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Molecular Mass | 562.3223 |
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SMILES | CCCCCCCCC=CCCCCCCCC(=O)NC(NCC(=O)O)C(N)CSSCC(N)C(=O)O |
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InChI Key | IXOPGQNSUFHXHP-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 | alpha amino acidsamino acidscarbonyl compoundscarboxylic acidsdialkylaminesdialkyldisulfidesdicarboxylic acids and derivativeshydrocarbon derivativesmonoalkylaminesn-acyl aminesorganic oxidesorganopnictogen compoundssecondary carboxylic acid amidessulfenyl compounds |
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Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidamino acidfatty amideorganosulfur compoundorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundsecondary aliphatic aminesulfenyl compoundsecondary aminecarboxamide groupn-acyl-aminesecondary carboxylic acid amidedialkyldisulfideorganic oxygen compoundorganic disulfidecysteine or derivativesdicarboxylic acid or derivativeshydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compoundamine |
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