| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 06:23:53 UTC |
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| Update Date | 2025-03-24 16:49:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00971978 |
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| Frequency | 1.5 |
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| Structure | |
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| Chemical Formula | C6H12O3 |
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| Molecular Mass | 132.0786 |
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| SMILES | CC(=O)C(OO)C(C)C |
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| InChI Key | NTAUGUQNNYBRPR-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 | organic hydroperoxides |
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| Subclass | organic hydroperoxides |
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| Direct Parent | organic hydroperoxides |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkyl hydroperoxideshydrocarbon derivativesketonesorganic oxidesperoxols |
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| Substituents | ketonealiphatic acyclic compoundcarbonyl grouporganic oxidealkyl hydroperoxidehydroperoxidehydrocarbon derivativeperoxolorganooxygen compound |
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