| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:17:14 UTC |
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| Update Date | 2025-03-25 01:00:01 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02240631 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H20O4 |
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| Molecular Mass | 228.1362 |
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| SMILES | CC(C)(C)C(=O)OC1(C(=O)O)CCCCC1 |
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| InChI Key | PAIXAKARJYJDDJ-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 | dicarboxylic acids and derivatives |
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| Direct Parent | dicarboxylic acids and derivatives |
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| Geometric Descriptor | aliphatic homomonocyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acid esterscarboxylic acidshydrocarbon derivativesorganic oxides |
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| Substituents | carbonyl grouporganic oxidecarboxylic acidorganic oxygen compoundcarboxylic acid esteraliphatic homomonocyclic compounddicarboxylic acid or derivativeshydrocarbon derivativeorganooxygen compound |
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