| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:15:04 UTC |
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| Update Date | 2025-03-25 00:59:12 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02235765 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H12O3 |
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| Molecular Mass | 144.0786 |
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| SMILES | OCC12CCC(CO1)CO2 |
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| InChI Key | YTJLEUBOLCAVHG-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 | 1,3-dioxanesalcohols and polyolshydrocarbon derivativesoxacyclic compoundsoxanes |
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| Substituents | alcoholaliphatic heteropolycyclic compoundoxacycleketalhydrocarbon derivativeoxanemeta-dioxaneorganoheterocyclic compound |
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