Record Information |
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HMDB Status | expected |
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Creation Date | 2024-02-21 00:27:27 UTC |
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Update Date | 2025-03-21 18:40:01 UTC |
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HMDB ID | HMDB0010334 |
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Metabolite Identification |
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DeepMet ID | DMID00128150 |
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Name | Ketoprofen glucuronide |
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Frequency | 19.9 |
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Structure | |
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Chemical Formula | C22H22O9 |
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Molecular Mass | 430.1264 |
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SMILES | CC(C(=O)OC1OC(C(=O)O)C(O)C(O)C1O)c1cccc(C(=O)c2ccccc2)c1 |
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InChI Key | PBTXSZZKPHBHMA-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | benzenoids |
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Class | benzene and substituted derivatives |
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Subclass | benzophenones |
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Direct Parent | benzophenones |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | acetalsaryl ketonesaryl-phenylketonesbenzoyl derivativesbeta hydroxy acids and derivativescarboxylic acid esterscarboxylic acidsdicarboxylic acids and derivativesdiphenylmethanesglucuronic acid derivativeshydrocarbon derivativesmonosaccharideso-glucuronidesorganic oxidesoxacyclic compoundsoxanespyran carboxylic acidssecondary alcohols |
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Substituents | diphenylmethanecarbonyl groupcarboxylic acidglucuronic acid or derivativesaromatic heteromonocyclic compoundbenzoylo-glucuronidemonosaccharidecarboxylic acid derivativepyran carboxylic acidbenzophenoneketone1-o-glucuronidebeta-hydroxy acidsaccharideorganic oxideacetaloxaneorganoheterocyclic compoundalcoholpyran carboxylic acid or derivativesaryl-phenylketonehydroxy acidoxacycleorganic oxygen compoundpyrancarboxylic acid estersecondary alcoholdicarboxylic acid or derivativeshydrocarbon derivativeorganooxygen compoundaryl ketone |
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