| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:55:13 UTC |
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| Update Date | 2025-03-25 00:51:56 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02190411 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H14O3 |
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| Molecular Mass | 158.0943 |
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| SMILES | CC(=O)C1CCOC(C)(C)O1 |
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| InChI Key | IIARULWACJILFX-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 | ethers |
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| Direct Parent | ketals |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | 1,3-dioxaneshydrocarbon derivativesketonesorganic oxidesoxacyclic compounds |
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| Substituents | carbonyl groupketoneoxacycleorganic oxideketalaliphatic heteromonocyclic compoundhydrocarbon derivativemeta-dioxaneorganoheterocyclic compound |
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