Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 05:28:37 UTC |
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Update Date | 2025-03-24 14:20:28 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00839534 |
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Frequency | 1.8 |
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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 | COc1cc[nH]n1 |
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InChI Key | ZGSNZVRXASCXRP-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 derivativesorganonitrogen compoundsorganopnictogen compoundspyrazoles |
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Substituents | aromatic heteromonocyclic compoundazacycleheteroaromatic compoundalkyl aryl etherpyrazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundazole |
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