| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:50:37 UTC |
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| Update Date | 2025-03-21 18:02:44 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00039995 |
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| Frequency | 86.6 |
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| Structure | |
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| Chemical Formula | C11H20NO8+ |
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| Molecular Mass | 294.1183 |
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| SMILES | C[N+](C)(C)CC(=O)OC1OC(C(=O)O)C(O)C(O)C1O |
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| InChI Key | YJSRPTFWEFKQSW-UHFFFAOYSA-O |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbohydrates and carbohydrate conjugates |
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| Direct Parent | o-glucuronides |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | acetalsalpha amino acid estersalpha amino acidsaminesbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acid esterscarboxylic acidsdicarboxylic acids and derivativesglucuronic acid derivativeshydrocarbon derivativesmonosaccharidesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundsoxacyclic compoundsoxanespyran carboxylic acidssecondary alcoholstetraalkylammonium salts |
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| Substituents | carbonyl groupcarboxylic acido-glucuronidemonosaccharidealpha-amino acid or derivativescarboxylic acid derivativepyran carboxylic acid1-o-glucuronidebeta-hydroxy acidorganic oxideacetalaliphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganic cationoxaneorganic saltorganoheterocyclic compoundalcoholpyran carboxylic acid or derivativestetraalkylammonium saltalpha-amino acid esterquaternary ammonium salthydroxy acidoxacyclepyrancarboxylic acid estersecondary alcoholdicarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundamine |
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