| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:17:50 UTC |
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| Update Date | 2025-03-21 18:35:19 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00105030 |
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| Frequency | 25.7 |
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| Structure | |
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| Chemical Formula | C9H18NO3+ |
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| Molecular Mass | 188.1281 |
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| SMILES | C[N+](C)(C)CCC(=O)CCC(=O)O |
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| InChI Key | OQRVBXBHYJSASS-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 | medium-chain keto acids and derivatives |
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| Direct Parent | medium-chain keto acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | aminesamino fatty acidsbeta-amino ketonescarboxylic acidsfatty acylsgamma-keto acids and derivativeshydrocarbon derivativesmonocarboxylic acids and derivativesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundstetraalkylammonium salts |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidcarboxylic acid derivativeketoneorganic oxideorganonitrogen compoundorganopnictogen compoundorganic cationbeta-aminoketoneorganic salttetraalkylammonium saltquaternary ammonium saltamino fatty acidgamma-keto acidmonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compoundmedium-chain keto acid |
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