| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 10:08:51 UTC |
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| Update Date | 2025-03-24 20:37:37 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01511036 |
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| Frequency | 0.8 |
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| Structure | |
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| Chemical Formula | C6H9NO3 |
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| Molecular Mass | 143.0582 |
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| SMILES | CC1(C)OC2C=NOC2O1 |
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| InChI Key | XIRRQNPUBXKEDH-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-dioxolanesazacyclic compoundshydrocarbon derivativesisoxazolinesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsoxacyclic compounds |
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| Substituents | meta-dioxolaneazacycleisoxazolinealiphatic heteropolycyclic compoundoxacycleketalorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compound |
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