| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:54:33 UTC |
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| Update Date | 2025-03-25 00:51:43 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02188900 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H21NO5 |
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| Molecular Mass | 271.142 |
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| SMILES | CC(O)CCCC=C(C(=O)O)N1CCCC1C(=O)O |
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| InChI Key | SWGJMCNEMZKPPL-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 | proline and derivatives |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acidsamino acidsamino fatty acidsazacyclic compoundscarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativesenaminesheterocyclic fatty acidshydrocarbon derivativeshydroxy fatty acidsmedium-chain fatty acidsmedium-chain hydroxy acids and derivativesorganic oxidesorganopnictogen compoundspyrrolidine carboxylic acidssecondary alcoholstrialkylaminesunsaturated fatty acids |
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| Substituents | fatty acylcarbonyl groupcarboxylic acidamino acidheterocyclic fatty acidfatty acidmedium-chain hydroxy acidunsaturated fatty acidorganic oxidepyrrolidine carboxylic acidaliphatic heteromonocyclic compoundalpha-amino acidorganonitrogen compoundorganopnictogen compoundmedium-chain fatty acidhydroxy fatty acidpyrrolidinetertiary amineorganoheterocyclic compoundproline or derivativesalcoholazacycletertiary aliphatic amineamino fatty acidpyrrolidine carboxylic acid or derivativesorganic oxygen compoundsecondary alcoholdicarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compoundenamine |
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