Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 02:04:17 UTC |
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Update Date | 2025-03-21 20:46:36 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00353131 |
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Frequency | 5.4 |
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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 | C1CC2OC1C1OC21 |
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InChI Key | KLBCNXTVEQUQDA-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 | oxepanes |
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Subclass | oxepanes |
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Direct Parent | oxepanes |
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Geometric Descriptor | aliphatic heteropolycyclic compounds |
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Alternative Parents | 1,4-dioxanesdialkyl ethersepoxideshydrocarbon derivativesoxacyclic compoundstetrahydrofurans |
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Substituents | ethertetrahydrofuranoxiranedialkyl etheraliphatic heteropolycyclic compoundoxepaneoxacycleorganic oxygen compoundpara-dioxanehydrocarbon derivativeorganooxygen compound |
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