Record Information |
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HMDB Status | predicted |
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Creation Date | 2024-02-21 00:18:03 UTC |
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Update Date | 2025-03-21 18:35:25 UTC |
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HMDB ID | HMDB0125146 |
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Metabolite Identification |
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DeepMet ID | DMID00105557 |
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Name | 6-(2-formyl-3,5-dihydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid |
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Frequency | 25.6 |
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Structure | |
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Chemical Formula | C13H14O10 |
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Molecular Mass | 330.0587 |
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SMILES | O=Cc1c(O)cc(O)cc1OC1OC(C(=O)O)C(O)C(O)C1O |
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InChI Key | UZHIESYOFIERQK-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 | o-glucuronides |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsacetalsbenzoyl derivativesbeta hydroxy acids and derivativescarboxylic acidsglucuronic acid derivativeshydrocarbon derivativeshydroxybenzaldehydesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesoxacyclic compoundsoxanesphenol ethersphenoxy compoundspyran carboxylic acidsresorcinolssecondary alcoholsvinylogous acids |
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Substituents | phenol ethermonocyclic benzene moietycarbonyl groupcarboxylic acidaromatic heteromonocyclic compoundbenzoylo-glucuronide1-hydroxy-2-unsubstituted benzenoidmonosaccharidecarboxylic acid derivativepyran carboxylic acidresorcinol1-o-glucuronidebeta-hydroxy acidorganic oxidearyl-aldehydeacetaloxaneorganoheterocyclic compoundalcoholpyran carboxylic acid or derivativesaldehydehydroxy acid1-hydroxy-4-unsubstituted benzenoidoxacyclevinylogous acidbenzaldehydemonocarboxylic acid or derivativespyransecondary alcoholphenolhydrocarbon derivativebenzenoidphenoxy compoundhydroxybenzaldehyde |
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