| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:37:06 UTC |
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| Update Date | 2025-03-21 17:57:34 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00008702 |
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| Frequency | 561.5 |
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| Structure | |
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| Chemical Formula | C10H17NO4 |
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| Molecular Mass | 215.1158 |
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| SMILES | CCCCCC(=CC(=O)O)NCC(=O)O |
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| InChI Key | DIBPGEMTPXNOIZ-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 acyclic compounds |
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| Alternative Parents | amino acidsamino fatty acidscarbonyl compoundscarboxylic acidsdialkylaminesdicarboxylic acids and derivativeshydrocarbon derivativesmedium-chain fatty acidsorganic oxidesorganopnictogen compoundsunsaturated fatty acidsvinylogous amides |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidamino acidfatty acidunsaturated fatty acidorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundmedium-chain fatty acidvinylogous amidesecondary aliphatic aminesecondary amineamino fatty acidorganic oxygen compounddicarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
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