| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:49:20 UTC |
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| Update Date | 2025-03-25 00:49:50 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02176986 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H16N2O7 |
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| Molecular Mass | 300.0958 |
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| SMILES | CC(=O)Nc1c(O)c(=O)ccn1C1OC(CO)C(O)C1O |
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| InChI Key | QKOFFDSRTWYHOE-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic nitrogen compounds |
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| Class | organonitrogen compounds |
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| Subclass | n-arylamides |
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| Direct Parent | n-acetylarylamines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2-halopyridinesacetamidesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativescyclic ketonesheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmethylpyridinesmonosaccharidesorganic oxidesorganopnictogen compoundsoxacyclic compoundspolyhalopyridinesprimary alcoholssecondary alcoholssecondary carboxylic acid amidestetrahydrofuransvinylogous amides |
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| Substituents | carbonyl groupn-acetylarylaminearomatic heteromonocyclic compoundpolyhalopyridinemonosaccharidecyclic ketonecarboxylic acid derivativesaccharideorganic oxideorganopnictogen compound2-halopyridineprimary alcoholorganoheterocyclic compoundacetamidealcoholvinylogous amideazacycletetrahydrofuranheteroaromatic compoundhydroxypyridinemethylpyridinecarboxamide groupoxacyclesecondary carboxylic acid amidepyridineorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganooxygen compound |
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