| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:20:29 UTC |
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| Update Date | 2025-03-25 00:39:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02110695 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C5H6O2 |
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| Molecular Mass | 98.0368 |
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| SMILES | C1C2OC3OC3C12 |
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| InChI Key | BQFGAYVSUZASOZ-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 | 1,3-dioxepanes |
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| Direct Parent | 1,3-dioxepanes |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | 1,3-dioxanesepoxideshydrocarbon derivativesorganooxygen compoundsoxacyclic compoundsoxanestetrahydrofurans |
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| Substituents | 1,3-dioxepanetetrahydrofuranoxiranealiphatic heteropolycyclic compoundoxacycleorganic oxygen compoundhydrocarbon derivativeoxanemeta-dioxaneorganooxygen compound |
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