| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:52:28 UTC |
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| Update Date | 2025-03-21 18:03:28 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00044495 |
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| Frequency | 83.7 |
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| Structure | |
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| Chemical Formula | C16H28N6O5 |
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| Molecular Mass | 384.2121 |
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| SMILES | N=C(N)NCCCC(N)C(=O)N1CCCC1C(=O)N1CC(O)CC1C(=O)O |
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| InChI Key | JLIXCDAAXAKTTD-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 | oligopeptides |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acid amidesalpha amino acidsazacyclic compoundscarbonyl compoundscarboximidamidescarboxylic acidsguanidineshydrocarbon derivativesiminesmonoalkylaminesmonocarboxylic acids and derivativesn-acyl-alpha amino acidsn-acylpyrrolidinesorganic oxidesorganopnictogen compoundsproline and derivativespyrrolidine carboxylic acidspyrrolidinecarboxamidessecondary alcoholstertiary carboxylic acid amides |
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| Substituents | carbonyl groupcarboxylic acidguanidineiminen-acylpyrrolidinealpha-amino acid or derivativesorganic oxidepyrrolidine carboxylic acidtertiary carboxylic acid amidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundpyrrolidineorganoheterocyclic compoundn-acyl-alpha amino acid or derivativesproline or derivativesalcoholalpha-amino acid amideazacyclen-acyl-alpha-amino acidcarboximidamidecarboxamide groupmonocarboxylic acid or derivativespyrrolidine carboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativeprimary aliphatic aminealpha-oligopeptideorganic nitrogen compoundpyrrolidine-2-carboxamideorganooxygen compound |
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