| Record Information |
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| HMDB Status | predicted |
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| Creation Date | 2024-02-21 00:06:40 UTC |
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| Update Date | 2025-03-21 18:29:34 UTC |
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| HMDB ID | HMDB0127956 |
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| Metabolite Identification |
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| DeepMet ID | DMID00078169 |
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| Name | 2-[(6-carboxy-3,4,5-trihydroxyoxan-2-yl)oxy]-3-hydroxybutanedioic acid |
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| Frequency | 37.5 |
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| Structure | |
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| Chemical Formula | C10H14O12 |
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| Molecular Mass | 326.0485 |
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| SMILES | O=C(O)C(O)C(OC1OC(C(=O)O)C(O)C(O)C1O)C(=O)O |
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| InChI Key | ZNTQYJCHCKXGEK-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 | aliphatic heteromonocyclic compounds |
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| Alternative Parents | acetalsalpha hydroxy acids and derivativesbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acidsglucuronic acid derivativeshydrocarbon derivativesmonosaccharidesorganic oxidesoxacyclic compoundsoxanespyran carboxylic acidssecondary alcoholstricarboxylic acids and derivatives |
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| Substituents | carbonyl groupcarboxylic acidalpha-hydroxy acido-glucuronidemonosaccharidetricarboxylic acid or derivativescarboxylic acid derivativepyran carboxylic acid1-o-glucuronidebeta-hydroxy acidorganic oxideacetalaliphatic heteromonocyclic compoundoxaneorganoheterocyclic compoundalcoholpyran carboxylic acid or derivativeshydroxy acidoxacyclepyransecondary alcoholhydrocarbon derivative |
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