| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:17:52 UTC |
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| Update Date | 2025-03-25 01:00:19 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02242111 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H24N4O3S |
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| Molecular Mass | 328.1569 |
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| SMILES | CC(C)CC(N=C(N)CCC1SCC2NC(=O)NC21)C(=O)O |
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| InChI Key | QCSZSTDXGMYSPL-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 | leucine and derivatives |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | alpha amino acidsamidinesazacyclic compoundscarbonyl compoundscarboximidamidescarboxylic acidsdialkylthioethersheterocyclic fatty acidshydrocarbon derivativesimidazolidinonesmethyl-branched fatty acidsmonocarboxylic acids and derivativesorganic carbonic acids and derivativesorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundsthienoimidazolidinesthiolanesthiophenes |
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| Substituents | thiolaneimidazolidinefatty acylcarbonyl groupcarboxylic acidheterocyclic fatty acidfatty acidamidinethiophenepropargyl-type 1,3-dipolar organic compoundaliphatic heteropolycyclic compoundimidazolidinoneorganic oxideleucine or derivativesorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundcarbonic acid derivativemethyl-branched fatty acidazacycledialkylthioetherorganic 1,3-dipolar compoundcarboximidamidethienoimidazolidinebranched fatty acidmonocarboxylic acid or derivativesorganic oxygen compoundthioetherhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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