| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:15:00 UTC |
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| Update Date | 2025-03-21 18:33:53 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00098106 |
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| Frequency | 28.1 |
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| Structure | |
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| Chemical Formula | C13H22O2 |
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| Molecular Mass | 210.162 |
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| SMILES | CC1=CCCC(C)(C)C1(C)CCC(=O)O |
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| InChI Key | GNOBMQODVMYDBK-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 acids |
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| Direct Parent | carboxylic acids |
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| Geometric Descriptor | aliphatic homomonocyclic compounds |
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| Alternative Parents | carbonyl compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
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| Substituents | carbonyl grouporganic oxidemonocarboxylic acid or derivativescarboxylic acidorganic oxygen compoundaliphatic homomonocyclic compoundhydrocarbon derivativeorganooxygen compound |
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