| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:55:52 UTC |
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| Update Date | 2025-03-25 00:52:09 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02191821 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H26N2O11 |
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| Molecular Mass | 422.1537 |
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| SMILES | CC(=O)NC1C(O)CC(OCC2CC(O)C(=O)N2)(C(=O)O)OC1C(O)C(O)CO |
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| InChI Key | OXAFFTJSVCWADM-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 | acetamidesazacyclic compoundscarbonyl compoundscarboxylic acidshydrocarbon derivativesketalslactamsmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanesprimary alcoholspyran carboxylic acidspyrrolidine-2-onessecondary alcoholssecondary carboxylic acid amides |
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| Substituents | 2-pyrrolidonecarbonyl grouplactamcarboxylic acidcarboxylic acid derivativepyran carboxylic acidorganic oxideacetalketalaliphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundoxanepyrrolidineprimary alcoholpyrrolidoneorganoheterocyclic compoundacetamidec-glucuronidealcoholpyran carboxylic acid or derivativesazacyclecarboxamide groupoxacyclesecondary carboxylic acid amidemonocarboxylic acid or derivativespyransecondary alcoholhydrocarbon derivativeorganic nitrogen compound |
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