Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:36:01 UTC |
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Update Date | 2025-03-21 17:57:10 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00006174 |
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Frequency | 866.4 |
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Structure | |
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Chemical Formula | C8H13NO7 |
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Molecular Mass | 235.0692 |
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SMILES | CC(=O)NC1C(C(=O)O)OC(O)C(O)C1O |
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InChI Key | XITJSDWDBRSGSI-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 | glucuronic acid derivatives |
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Geometric Descriptor | aliphatic heteromonocyclic compounds |
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Alternative Parents | 1,2-diolsacetamidescarbonyl compoundscarboxylic acidshemiacetalshydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanespyran carboxylic acidssecondary alcoholssecondary carboxylic acid amides |
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Substituents | carbonyl groupcarboxylic acidglucuronic acid or derivativesmonosaccharidecarboxylic acid derivativepyran carboxylic acidorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhemiacetaloxaneorganoheterocyclic compoundacetamide1,2-diolalcoholpyran carboxylic acid or derivativescarboxamide groupoxacyclesecondary carboxylic acid amidemonocarboxylic acid or derivativespyransecondary alcoholhydrocarbon derivativeorganic nitrogen compound |
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