| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:35:40 UTC |
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| Update Date | 2025-03-21 17:57:04 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00005408 |
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| Frequency | 990.3 |
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| Structure | |
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| Chemical Formula | C9H20NO2+ |
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| Molecular Mass | 174.1489 |
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| SMILES | C[N+](C)(C)CCCCCC(=O)O |
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| InChI Key | BGKJBMGXIZZWFR-UHFFFAOYSA-O |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | fatty acyls |
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| Subclass | fatty acids and conjugates |
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| Direct Parent | medium-chain fatty acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | aminesamino fatty acidscarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundsstraight chain fatty acidstetraalkylammonium salts |
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| Substituents | aliphatic acyclic compoundcarbonyl groupstraight chain fatty acidcarboxylic acidtetraalkylammonium saltquaternary ammonium saltcarboxylic acid derivativeamino fatty acidorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativemedium-chain fatty acidorganic nitrogen compoundorganic cationorganic saltamineorganooxygen compound |
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