| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:44:52 UTC |
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| Update Date | 2025-03-21 18:00:17 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00026358 |
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| Frequency | 145.4 |
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| Structure | |
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| Chemical Formula | C9H13NO6 |
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| Molecular Mass | 231.0743 |
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| SMILES | O=C(O)C(CCN1CCC1C(=O)O)C(=O)O |
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| InChI Key | WLEMAOAMWKGHJS-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 | 1,3-dicarbonyl compoundsamino acidsamino fatty acidsazacyclic compoundsazetidinecarboxylic acidsazetidinescarboxylic acidsfatty acylshydrocarbon derivativesorganic oxidesorganopnictogen compoundstrialkylaminestricarboxylic acids and derivatives |
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| Substituents | fatty acylcarbonyl groupcarboxylic acidamino acidazetidinecarboxylic acidtricarboxylic acid or derivativesorganic oxidealiphatic heteromonocyclic compoundalpha-amino acidorganonitrogen compoundorganopnictogen compoundtertiary amineorganoheterocyclic compoundazacycletertiary aliphatic amineamino fatty acidazetidineorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compound1,3-dicarbonyl compoundamineorganooxygen compound |
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