| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:41:47 UTC |
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| Update Date | 2025-03-21 17:59:11 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00019314 |
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| Frequency | 212.3 |
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| Structure | |
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| Chemical Formula | C7H16NO4+ |
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| Molecular Mass | 178.1074 |
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| SMILES | C[N+](C)(C)CC(O)C(O)C(=O)O |
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| InChI Key | ZOPACRMLVDFSGJ-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 | 1,2-aminoalcohols1,2-diols1,3-aminoalcoholsalpha hydroxy acids and derivativesaminescarbonyl compoundscarboxylic acidshydrocarbon derivativeshydroxy fatty acidsmonocarboxylic acids and derivativesmonosaccharidesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundssecondary alcoholsshort-chain hydroxy acids and derivativestetraalkylammonium salts |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidshort-chain hydroxy acidalpha-hydroxy acidmonosaccharidefatty acidcarboxylic acid derivativebeta-hydroxy acidsaccharideorganic oxideorganonitrogen compoundorganopnictogen compoundhydroxy fatty acidorganic cationorganic salt1,2-diolalcohol1,3-aminoalcoholtetraalkylammonium salt1,2-aminoalcoholquaternary ammonium saltmonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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