| Record Information |
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| HMDB Status | detected |
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| Creation Date | 2024-02-20 23:35:27 UTC |
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| Update Date | 2025-03-21 17:56:59 UTC |
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| HMDB ID | HMDB0039721 |
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| Metabolite Identification |
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| DeepMet ID | DMID00004907 |
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| Name | 4-O-alpha-D-Galactopyranuronosyl-D-galacturonic acid |
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| Frequency | 1118.0 |
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| Structure | |
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| Chemical Formula | C12H18O13 |
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| Molecular Mass | 370.0747 |
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| SMILES | O=C(O)C1OC(OC2C(C(=O)O)OC(O)C(O)C2O)C(O)C(O)C1O |
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| InChI Key | IGSYEZFZPOZFNC-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 | acetalsbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativesglucuronic acid derivativeshemiacetalshydrocarbon derivativesmonosaccharidesorganic oxidesoxacyclic compoundsoxanespyran carboxylic acidssecondary alcohols |
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| Substituents | carbonyl groupcarboxylic acido-glucuronidemonosaccharidecarboxylic acid derivativepyran carboxylic acid1-o-glucuronidebeta-hydroxy acidorganic oxideacetalaliphatic heteromonocyclic compoundhemiacetaloxaneorganoheterocyclic compoundalcoholpyran carboxylic acid or derivativeshydroxy acidoxacyclepyransecondary alcoholdicarboxylic acid or derivativeshydrocarbon derivative |
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