| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 16:14:24 UTC |
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| Update Date | 2025-03-25 01:21:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02372076 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H8O2 |
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| Molecular Mass | 112.0524 |
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| SMILES | C1OC2CC1C1OC21 |
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| InChI Key | HZSQPJYNTMFAFM-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | dioxepanes |
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| Subclass | 1,4-dioxepanes |
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| Direct Parent | 1,4-dioxepanes |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | dialkyl ethersepoxideshydrocarbon derivativesoxacyclic compoundsoxanestetrahydrofurans |
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| Substituents | ethertetrahydrofuran1,4-dioxepaneoxiranedialkyl etheraliphatic heteropolycyclic compoundoxacycleorganic oxygen compoundhydrocarbon derivativeoxaneorganooxygen compound |
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