| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:16:25 UTC |
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| Update Date | 2025-03-21 18:34:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00101547 |
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| Frequency | 26.9 |
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| Structure | |
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| Chemical Formula | C5H11NO3 |
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| Molecular Mass | 133.0739 |
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| SMILES | CC(C(=O)O)[N+](C)(C)[O-] |
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| InChI Key | VXBCBEJEFNHZFT-UHFFFAOYSA-N |
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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 | carboxylic acids and derivatives |
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| Subclass | amino acids, peptides, and analogues |
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| Direct Parent | alanine and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha amino acidscarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganic oxoanionic compoundsorganopnictogen compoundstrialkyl amine oxidestrisubstituted amine oxides and derivatives |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidn-oxidetrialkyl amine oxideorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundtrisubstituted n-oxideaminoxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundalanine or derivativeshydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundorganic hyponitrite |
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