Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:34:21 UTC |
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Update Date | 2025-03-21 17:56:35 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00002292 |
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Frequency | 2652.2 |
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Structure | |
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Chemical Formula | C8H15NO7 |
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Molecular Mass | 237.0849 |
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SMILES | NC1C(O)CC(O)(C(=O)O)OC1C(O)CO |
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InChI Key | KNNQEPYJUMAQSI-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | organic oxygen compounds |
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Class | organooxygen compounds |
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Subclass | carbohydrates and carbohydrate conjugates |
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Direct Parent | c-glucuronides |
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Geometric Descriptor | aliphatic heteromonocyclic compounds |
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Alternative Parents | alpha hydroxy acids and derivativescarbonyl compoundscarboxylic acidsdelta amino acids and derivativeshemiacetalshydrocarbon derivativesmonoalkylaminesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanesprimary alcoholspyran carboxylic acidssecondary alcohols |
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Substituents | carbonyl groupcarboxylic acidalpha-hydroxy acidcarboxylic acid derivativepyran carboxylic acidorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhemiacetaldelta amino acid or derivativesoxaneprimary alcoholorganoheterocyclic compoundc-glucuronidealcoholpyran carboxylic acid or derivativeshydroxy acidoxacyclemonocarboxylic acid or derivativespyransecondary alcoholhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compound |
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