| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:00:25 UTC |
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| Update Date | 2025-03-25 00:53:49 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02202194 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C19H36N3O3S+ |
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| Molecular Mass | 386.2472 |
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| SMILES | C[N+](C)(C)CCOC(=O)CCCCCCCCC1SCC2NC(=O)NC21 |
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| InChI Key | BNFZGLXOZFXTNA-UHFFFAOYSA-O |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic nitrogen compounds |
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| Class | organonitrogen compounds |
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| Subclass | quaternary ammonium salts |
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| Direct Parent | acyl cholines |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | aminesazacyclic compoundscarbonyl compoundscarboxylic acid estersdialkylthioethersfatty acid estershydrocarbon derivativesimidazolidinonesmonocarboxylic acids and derivativesorganic carbonic acids and derivativesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundstetraalkylammonium saltsthienoimidazolidinesthiolanesthiophenes |
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| Substituents | thiolaneimidazolidinefatty acylcarbonyl groupthiophenecarboxylic acid derivativealiphatic heteropolycyclic compoundimidazolidinoneorganic oxideorganopnictogen compoundorganic cationorganic saltorganoheterocyclic compoundcarbonic acid derivativetetraalkylammonium saltazacycledialkylthioetherthienoimidazolidinefatty acid estermonocarboxylic acid or derivativesorganic oxygen compoundthioethercarboxylic acid esteracyl cholinehydrocarbon derivativeamineorganooxygen compound |
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