| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:50:19 UTC |
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| Update Date | 2025-03-25 00:50:10 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02179213 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H14NO7+ |
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| Molecular Mass | 236.0765 |
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| SMILES | C[N+](=O)C1(C(=O)O)CC(O)C(O)C(CO)O1 |
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| InChI Key | MCBAUYQQBUNDGK-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 | carboxylic acids and derivatives |
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| Subclass | amino acids, peptides, and analogues |
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| Direct Parent | alpha amino acids |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | aminoxidescarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharidesorganic cationsorganic oxidesorganic oxoazanium compoundsorganopnictogen compoundsoxacyclic compoundsoxanesprimary alcoholspyran carboxylic acidssecondary alcohols |
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| Substituents | carbonyl groupcarboxylic acidmonosaccharidepyran carboxylic acidsaccharideorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganic cationorganic oxoazaniumoxaneprimary alcoholorganoheterocyclic compoundalcoholpyran carboxylic acid or derivativesoxacyclemonocarboxylic acid or derivativesorganic oxygen compoundaminoxidepyransecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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