| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:05:49 UTC |
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| Update Date | 2025-03-21 18:29:11 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00076078 |
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| Frequency | 38.8 |
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| Structure | |
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| Chemical Formula | C9H16O3 |
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| Molecular Mass | 172.1099 |
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| SMILES | C=CC1(C)OCC(C(C)(C)O)O1 |
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| InChI Key | FTVPQQXOXRFCSZ-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-dioxolaneshydrocarbon derivativesoxacyclic compoundstertiary alcohols |
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| Substituents | alcoholoxacyclemeta-dioxolanetertiary alcoholketalaliphatic heteromonocyclic compoundhydrocarbon derivativeorganoheterocyclic compound |
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