| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:18:36 UTC |
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| Update Date | 2025-03-25 01:00:38 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02243811 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H20N2O11 |
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| Molecular Mass | 380.1067 |
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| SMILES | CC(=O)NC1C(O)CC(O)(C(=O)O)OC1C(O)C(NCC(=O)O)C(=O)O |
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| InChI Key | YEBLWQLXILXSHO-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 | acetamidesalpha amino acidsalpha hydroxy acids and derivativesamino acidsbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acidsdialkylamineshemiacetalshydrocarbon derivativesorganic oxidesorganopnictogen compoundsoxacyclic compoundsoxanespyran carboxylic acidssecondary alcoholssecondary carboxylic acid amidestricarboxylic acids and derivatives |
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| Substituents | carbonyl groupcarboxylic acidamino acid or derivativesamino acidalpha-hydroxy acidtricarboxylic acid or derivativesalpha-amino acid or derivativescarboxylic acid derivativepyran carboxylic acidbeta-hydroxy acidorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundhemiacetaloxaneorganoheterocyclic compoundacetamidec-glucuronidealcoholsecondary aliphatic aminepyran carboxylic acid or derivativeshydroxy acidsecondary aminecarboxamide groupoxacyclesecondary carboxylic acid amidepyransecondary alcoholhydrocarbon derivativeorganic nitrogen compoundamine |
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