| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:40:01 UTC |
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| Update Date | 2025-03-25 00:46:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02155865 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H20NO5+ |
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| Molecular Mass | 222.1336 |
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| SMILES | C[N+](C)(C)CC(O)(CC(=O)O)C(O)CO |
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| InChI Key | VPYDFZMRVBYFJL-UHFFFAOYSA-O |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | fatty acyls |
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| Subclass | fatty acids and conjugates |
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| Direct Parent | hydroxy fatty acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | 1,2-aminoalcohols1,3-aminoalcoholsaminesbranched fatty acidscarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundsprimary alcoholssecondary alcoholsshort-chain hydroxy acids and derivativestertiary alcoholstetraalkylammonium salts |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidshort-chain hydroxy acidcarboxylic acid derivativeorganic oxideorganonitrogen compoundorganopnictogen compoundhydroxy fatty acidorganic cationorganic saltprimary alcoholalcohol1,3-aminoalcoholtetraalkylammonium salt1,2-aminoalcoholquaternary ammonium saltbranched fatty acidtertiary alcoholmonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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