Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 02:07:36 UTC |
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Update Date | 2025-03-21 20:47:55 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00361014 |
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Frequency | 5.2 |
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Structure | |
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Chemical Formula | C4H6N2O |
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Molecular Mass | 98.048 |
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SMILES | COc1ncc[nH]1 |
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InChI Key | YQSPOXMPYQYCSI-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 | alkyl aryl ethers |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesorganonitrogen compoundsorganopnictogen compounds |
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Substituents | aromatic heteromonocyclic compoundazacycleheteroaromatic compoundalkyl aryl etherimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundazole |
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