| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:06:21 UTC |
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| Update Date | 2025-03-21 18:29:26 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00077426 |
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| Frequency | 37.9 |
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| Structure | |
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| Chemical Formula | C11H19NO4 |
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| Molecular Mass | 229.1314 |
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| SMILES | CC(C)CC(C(=O)O)N1CCCC1C(=O)O |
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| InChI Key | BTIVWJQHUYUKBF-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 heteromonocyclic compounds |
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| Alternative Parents | alpha amino acidsamino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativesheterocyclic fatty acidshydrocarbon derivativesmethyl-branched fatty acidsn-alkylpyrrolidinesorganic oxidesorganopnictogen compoundsproline and derivativespyrrolidine carboxylic acidstrialkylamines |
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| Substituents | fatty acylcarbonyl groupcarboxylic acidamino acidheterocyclic fatty acidfatty acidorganic oxideleucine or derivativespyrrolidine carboxylic acidaliphatic heteromonocyclic compoundalpha-amino acidorganonitrogen compoundorganopnictogen compoundpyrrolidinetertiary amineorganoheterocyclic compoundproline or derivativesmethyl-branched fatty acidazacyclen-alkylpyrrolidinetertiary aliphatic aminebranched fatty acidpyrrolidine carboxylic acid or derivativesorganic oxygen compounddicarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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