| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:17:59 UTC |
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| Update Date | 2025-03-25 01:00:22 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02242388 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H19NO4 |
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| Molecular Mass | 241.1314 |
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| SMILES | C=CCCCCC(C(=O)O)N1CCC1C(=O)O |
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| InChI Key | XGQHEITXUCGDMG-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 heteromonocyclic compounds |
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| Alternative Parents | amino acidsamino fatty acidsazacyclic compoundsazetidinecarboxylic acidsazetidinescarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativesfatty acylsheterocyclic fatty acidshydrocarbon derivativesmedium-chain fatty acidsorganic oxidesorganopnictogen compoundstrialkylamines |
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| Substituents | fatty acylcarbonyl groupcarboxylic acidamino acidheterocyclic fatty acidazetidinecarboxylic acidorganic oxidealiphatic heteromonocyclic compoundalpha-amino acidorganonitrogen compoundorganopnictogen compoundmedium-chain fatty acidtertiary amineorganoheterocyclic compoundazacycletertiary aliphatic amineamino fatty acidazetidineorganic oxygen compounddicarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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