| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 02:56:17 UTC |
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| Update Date | 2025-03-21 22:01:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00476379 |
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| Frequency | 3.6 |
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| Structure | |
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| Chemical Formula | C6H8O4 |
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| Molecular Mass | 144.0423 |
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| SMILES | OC1C(O)C2OC1C1OC21 |
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| InChI Key | PKJFBINCDZNNOL-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 | 1,2-diols1,4-dioxanescyclic alcohols and derivativesdialkyl ethersepoxideshydrocarbon derivativesmonosaccharidesoxacyclic compoundssecondary alcoholstetrahydrofurans |
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| Substituents | alcoholethertetrahydrofuranoxiranemonosaccharidecyclic alcoholdialkyl etheraliphatic heteropolycyclic compoundoxepaneoxacyclesaccharideorganic oxygen compoundpara-dioxanesecondary alcoholhydrocarbon derivativeorganooxygen compound1,2-diol |
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