| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:03:30 UTC |
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| Update Date | 2025-03-25 00:54:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02209298 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H14N2O3 |
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| Molecular Mass | 198.1004 |
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| SMILES | CC1(C)OCC(C(O)c2c[nH]cn2)O1 |
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| InChI Key | UMRMNPWQOLSECG-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 | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1,3-dioxolanesaromatic alcoholsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundssecondary alcohols |
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| Substituents | aromatic alcoholalcoholmeta-dioxolanearomatic heteromonocyclic compoundazacycleheteroaromatic compoundoxacycleimidazoleketalorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundazole |
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