| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:34:25 UTC |
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| Update Date | 2025-03-21 17:56:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00002445 |
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| Frequency | 2476.7 |
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| Structure | |
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| Chemical Formula | C7H12O8 |
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| Molecular Mass | 224.0532 |
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| SMILES | O=C(O)C1OC(O)(CO)C(O)C(O)C1O |
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| InChI Key | KCZRCSGNNCSYML-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 | glucuronic acid derivatives |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | beta hydroxy acids and derivativescarbonyl compoundscarboxylic acidshemiacetalshydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesoxacyclic compoundsoxanespyran carboxylic acidssecondary alcohols |
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| Substituents | alcoholcarbonyl groupcarboxylic acidpyran carboxylic acid or derivativesglucuronic acid or derivativesmonosaccharidehydroxy acidcarboxylic acid derivativepyran carboxylic acidoxacyclebeta-hydroxy acidorganic oxidemonocarboxylic acid or derivativespyranaliphatic heteromonocyclic compoundsecondary alcoholhemiacetalhydrocarbon derivativeoxaneorganoheterocyclic compound |
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