| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:13:56 UTC |
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| Update Date | 2025-03-25 00:58:50 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02233110 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H22O6 |
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| Molecular Mass | 262.1416 |
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| SMILES | CCC(C)C(=O)OC1C(O)C(C)C(O)C(O)C1O |
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| InChI Key | NAEWPBVGINMMGT-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 | alcohols and polyols |
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| Direct Parent | cyclohexanols |
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| Geometric Descriptor | aliphatic homomonocyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acid esterscyclitols and derivativesfatty acid estershydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
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| Substituents | fatty acylcarbonyl groupcyclohexanolcyclitol or derivativescyclic alcoholcarboxylic acid derivativefatty acid esterorganic oxidemonocarboxylic acid or derivativescarboxylic acid esteraliphatic homomonocyclic compoundhydrocarbon derivative |
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