| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:15:15 UTC |
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| Update Date | 2025-03-21 18:34:00 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00098666 |
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| Frequency | 27.9 |
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| Structure | |
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| Chemical Formula | C8H16NO5+ |
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| Molecular Mass | 206.1023 |
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| SMILES | C[N+](C)(C)C(CCC(=O)O)OC(=O)O |
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| InChI Key | SHIKFLHVEIPFQR-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 | hydroxy acids and derivatives |
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| Subclass | short-chain hydroxy acids and derivatives |
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| Direct Parent | short-chain hydroxy acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonic acid monoesterscarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic cationsorganic oxidesorganic saltsorganonitrogen compoundsorganopnictogen compoundsstraight chain fatty acidstetraalkylammonium salts |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupstraight chain fatty acidcarbonic acid derivativecarboxylic acidshort-chain hydroxy acidtetraalkylammonium saltfatty acidcarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativescarbonic acid monoesterorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cationorganic saltorganooxygen compound |
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