| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:10:26 UTC |
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| Update Date | 2025-03-25 00:57:32 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02225370 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H28O6 |
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| Molecular Mass | 316.1886 |
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| SMILES | CC(=O)OC(C(C)C)C(OC(C)=O)C(C)(C)OC(=O)C(C)C |
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| InChI Key | YSDWRFZCYAEJIP-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | tricarboxylic acids and derivatives |
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| Direct Parent | tricarboxylic acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acid estershydrocarbon derivativesorganic oxides |
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| Substituents | aliphatic acyclic compoundcarbonyl grouporganic oxideorganic oxygen compoundcarboxylic acid esterhydrocarbon derivativetricarboxylic acid or derivativesorganooxygen compound |
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