Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 01:19:59 UTC |
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Update Date | 2025-03-21 19:11:35 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00250830 |
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Frequency | 8.3 |
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Structure | |
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Chemical Formula | C7H12O2 |
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Molecular Mass | 128.0837 |
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SMILES | CCC(=O)CC=C(C)O |
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InChI Key | ABKOVBWVPQEWSH-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | organic oxygen compounds |
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Class | organooxygen compounds |
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Subclass | carbonyl compounds |
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Direct Parent | ketones |
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Geometric Descriptor | aliphatic acyclic compounds |
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Alternative Parents | hydrocarbon derivativesorganic oxides |
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Substituents | ketonealiphatic acyclic compoundorganic oxidehydrocarbon derivative |
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