Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:22:36 UTC |
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Update Date | 2025-03-21 18:37:39 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00116640 |
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Frequency | 22.5 |
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Structure | |
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Chemical Formula | C9H16O8 |
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Molecular Mass | 252.0845 |
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SMILES | CC(O)C(O)C1OC(O)(C(=O)O)CC(O)C1O |
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InChI Key | BTCCSEPSUCIDNH-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 | alpha hydroxy acids and derivativescarbonyl compoundscarboxylic acidshemiacetalshydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesoxacyclic compoundsoxanespyran carboxylic acidssecondary alcohols |
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Substituents | c-glucuronidealcoholcarbonyl groupcarboxylic acidpyran carboxylic acid or derivativesalpha-hydroxy acidmonosaccharidehydroxy acidcarboxylic acid derivativepyran carboxylic acidoxacycleorganic oxidemonocarboxylic acid or derivativespyranaliphatic heteromonocyclic compoundsecondary alcoholhemiacetalhydrocarbon derivativeoxaneorganoheterocyclic compound |
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