| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:50:24 UTC |
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| Update Date | 2025-03-21 18:02:39 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00039479 |
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| Frequency | 88.1 |
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| Structure | |
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| Chemical Formula | C9H18O3 |
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| Molecular Mass | 174.1256 |
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| SMILES | CCCCC(CC)COC(=O)O |
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| InChI Key | LXUJDFITFWBMQT-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 | organic carbonic acids and derivatives |
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| Subclass | carbonic acid monoesters |
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| Direct Parent | carbonic acid monoesters |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundshydrocarbon derivativesorganic oxides |
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| Substituents | aliphatic acyclic compoundcarbonyl grouporganic oxidecarbonic acid monoesterorganic oxygen compoundhydrocarbon derivativeorganooxygen compound |
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