| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:16:36 UTC |
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| Update Date | 2025-03-25 00:59:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02239161 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H16O9 |
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| Molecular Mass | 304.0794 |
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| SMILES | O=CC(O)C(OC1CC(C(=O)O)=CC(O)C1O)C(O)C=O |
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| InChI Key | BYCBEFIZQTZVHI-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 | monosaccharides |
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| Geometric Descriptor | aliphatic homomonocyclic compounds |
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| Alternative Parents | alpha-hydroxyaldehydescarboxylic acidscyclitols and derivativesdialkyl ethershydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidessecondary alcohols |
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| Substituents | alcoholcarbonyl groupethercarboxylic acidmonosaccharidealdehydecyclitol or derivativescarboxylic acid derivativedialkyl etherorganic oxidemonocarboxylic acid or derivativesalpha-hydroxyaldehydesecondary alcoholaliphatic homomonocyclic compoundhydrocarbon derivative |
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