| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:52:26 UTC |
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| Update Date | 2025-03-25 00:50:58 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02184001 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H27N3O3S2 |
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| Molecular Mass | 349.1494 |
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| SMILES | NC(CCCCNC(=O)C(N)CCCC1CCSS1)C(=O)O |
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| InChI Key | MSCFBVLWDTVZJY-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | dithiolanes |
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| Subclass | lipoamides |
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| Direct Parent | lipoamides |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | 1,2-dithiolanesalpha amino acid amidesalpha amino acidscarbonyl compoundscarboxylic acidsheterocyclic fatty acidshydrocarbon derivativesmedium-chain fatty acidsmonoalkylaminesmonocarboxylic acids and derivativesn-acyl aminesorganic disulfidesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amides |
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| Substituents | fatty acylcarbonyl groupcarboxylic acidheterocyclic fatty acidfatty amidefatty acidalpha-amino acid or derivativescarboxylic acid derivative1,2-dithiolaneorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundmedium-chain fatty acidalpha-amino acid amidecarboxamide groupn-acyl-aminesecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundorganic disulfidelipoamidehydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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