| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:55:43 UTC |
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| Update Date | 2025-03-21 18:04:40 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00052126 |
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| Frequency | 62.5 |
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| Structure | |
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| Chemical Formula | C8H16NO4+ |
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| Molecular Mass | 190.1074 |
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| SMILES | C[N+](C)(C)CC(O)CC(=O)C(=O)O |
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| InChI Key | UQCAJYBLNINJCE-UHFFFAOYSA-O |
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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 | keto acids and derivatives |
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| Subclass | short-chain keto acids and derivatives |
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| Direct Parent | short-chain keto acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | 1,2-aminoalcoholsalpha-hydroxy ketonesalpha-keto acids and derivativesaminesbeta-hydroxy ketonescarboxylic acidscholinesfatty acylsgamma-amino ketoneshydrocarbon derivativeshydroxy fatty acidsmonocarboxylic acids and derivativesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundssecondary alcoholstetraalkylammonium salts |
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| Substituents | fatty acylbeta-hydroxy ketonealiphatic acyclic compoundcarbonyl groupcarboxylic acidshort-chain keto acidalpha-hydroxy ketonecarboxylic acid derivativeketoneorganic oxideorganonitrogen compoundalpha-keto acidorganopnictogen compoundhydroxy fatty acidorganic cationorganic saltalcoholgamma-aminoketonetetraalkylammonium salt1,2-aminoalcoholquaternary ammonium saltmonocarboxylic acid or derivativesorganic oxygen compoundcholinesecondary alcoholhydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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