Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:17:07 UTC |
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Update Date | 2025-03-21 18:34:59 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00103276 |
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Frequency | 26.3 |
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Structure | |
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Chemical Formula | C14H24O14 |
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Molecular Mass | 416.1166 |
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SMILES | O=C(O)C1(OCC2OC(O)C(O)C(O)C2O)OC(C(O)CO)C(O)C(O)C1O |
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InChI Key | VIMGJHKGNKYEPH-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 | c-glucuronides |
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Geometric Descriptor | aliphatic heteromonocyclic compounds |
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Alternative Parents | beta hydroxy acids and derivativescarbonyl compoundscarboxylic acidsglucuronic acid derivativeshemiacetalshydrocarbon derivativesketalsmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesoxacyclic compoundsoxanesprimary alcoholspyran carboxylic acidssecondary alcohols |
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Substituents | carbonyl groupcarboxylic acidmonosaccharidecarboxylic acid derivativepyran carboxylic acidbeta-hydroxy acidorganic oxideacetalketalaliphatic heteromonocyclic compoundhemiacetaloxaneprimary alcoholorganoheterocyclic compoundc-glucuronidealcoholpyran carboxylic acid or derivativeshydroxy acidoxacyclemonocarboxylic acid or derivativespyransecondary alcoholhydrocarbon derivative |
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