| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:50:51 UTC |
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| Update Date | 2025-03-25 00:50:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02180481 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H22NO6+ |
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| Molecular Mass | 264.1442 |
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| SMILES | C[N+](C)(C)C1C(O)C(O)C(O)CC1(O)CC(=O)O |
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| InChI Key | IVTOQJHPMVDBHM-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 | alcohols and polyols |
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| Direct Parent | aminocyclitols and derivatives |
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| Geometric Descriptor | aliphatic homomonocyclic compounds |
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| Alternative Parents | 1,2-aminoalcoholsaminescarbonyl compoundscarboxylic acidscyclohexanolscyclohexylamineshydrocarbon derivativesmonocarboxylic acids and derivativesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundstertiary alcoholstetraalkylammonium salts |
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| Substituents | carbonyl groupcarboxylic acidcyclohexylaminecarboxylic acid derivativeorganic oxideorganonitrogen compoundorganopnictogen compoundorganic cationorganic saltaminocyclitol or derivativestetraalkylammonium salt1,2-aminoalcoholquaternary ammonium saltcyclohexanoltertiary alcoholmonocarboxylic acid or derivativessecondary alcoholaliphatic homomonocyclic compoundhydrocarbon derivativeorganic nitrogen compoundamine |
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