| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:39:52 UTC |
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| Update Date | 2025-03-25 00:46:29 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02155524 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H20O3 |
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| Molecular Mass | 200.1412 |
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| SMILES | CC(=O)C(C)C(C)(C)OC(=O)C(C)C |
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| InChI Key | CGNDYQHJPBJFLA-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 | carboxylic acid derivatives |
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| Direct Parent | carboxylic acid esters |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | hydrocarbon derivativesketonesmonocarboxylic acids and derivativesorganic oxides |
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| Substituents | ketonealiphatic acyclic compoundcarbonyl grouporganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterhydrocarbon derivativeorganooxygen compound |
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