| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:05:06 UTC |
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| Update Date | 2025-03-21 18:28:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00074385 |
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| Frequency | 39.9 |
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| Structure | |
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| Chemical Formula | C16H27N5O5S |
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| Molecular Mass | 401.1733 |
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| SMILES | NC(CCCCNC(=O)CCCCC1SC(=O)NC2NC(=O)NC21)C(=O)O |
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| InChI Key | YCPSMMLJVQVCTG-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 | alpha amino acids |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidsheterocyclic fatty acidshydrocarbon derivativesimidazolidinonesmedium-chain fatty acidsmonoalkylaminesmonocarboxylic acids and derivativesn-acyl aminesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amidesthiazinanesthiolactones |
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| Substituents | imidazolidinefatty acylcarbonyl groupcarboxylic acidheterocyclic fatty acidfatty amidefatty acidaliphatic heteropolycyclic compoundimidazolidinoneorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundmedium-chain fatty acidthiolactoneorganoheterocyclic compoundcarbonic acid derivativeazacyclecarboxamide groupn-acyl-aminesecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compound1,3-thiazinaneorganooxygen compound |
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