| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 07:11:05 UTC |
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| Update Date | 2025-03-24 19:56:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01083859 |
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| Frequency | 1.3 |
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| Structure | |
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| Chemical Formula | C7H16O2 |
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| Molecular Mass | 132.115 |
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| SMILES | CCCCC(C)COO |
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| InChI Key | HJLDLARBKXSJRD-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 derivativesperoxols |
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| Substituents | aliphatic acyclic compoundalkyl hydroperoxidehydroperoxidehydrocarbon derivativeperoxolorganooxygen compound |
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