| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:25:44 UTC |
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| Update Date | 2025-03-21 18:39:05 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00124009 |
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| Frequency | 20.8 |
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| Structure | |
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| Chemical Formula | C7H12O4 |
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| Molecular Mass | 160.0736 |
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| SMILES | CC1(C)OC2COOCC2O1 |
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| InChI Key | AJHFNAPYGKSPJE-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 heteropolycyclic compounds |
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| Alternative Parents | 1,2-dioxanes1,3-dioxolanesdialkyl peroxideshydrocarbon derivativesorganooxygen compoundsoxacyclic compounds |
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| Substituents | aliphatic heteropolycyclic compoundoxacyclemeta-dioxolaneketaldialkyl peroxidehydrocarbon derivativeortho-dioxaneorganoheterocyclic compound |
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