| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:56:02 UTC |
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| Update Date | 2025-03-25 00:52:12 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02192182 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C17H34NO5+ |
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| Molecular Mass | 332.2432 |
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| SMILES | CCCCCCCCC(O)CC(=O)OC(CC(=O)O)[N+](C)(C)C |
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| InChI Key | PXFXNRJQZWGWPY-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 | beta hydroxy acids and derivatives |
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| Direct Parent | beta hydroxy acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acid esterscarboxylic acidsdicarboxylic acids and derivativesfatty acid estershydrocarbon derivativesorganic cationsorganic oxidesorganic saltsorganonitrogen compoundsorganopnictogen compoundssecondary alcoholstetraalkylammonium salts |
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| Substituents | alcoholfatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidtetraalkylammonium saltcarboxylic acid derivativefatty acid esterbeta-hydroxy acidorganic oxideorganic oxygen compoundcarboxylic acid esterorganonitrogen compoundsecondary alcoholdicarboxylic acid or derivativesorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cationorganic saltorganooxygen compound |
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