Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 09:48:33 UTC |
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Update Date | 2025-03-24 20:29:07 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID01462012 |
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Frequency | 0.9 |
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Structure | |
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Chemical Formula | C6H7O2+ |
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Molecular Mass | 111.0441 |
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SMILES | COc1cccc[o+]1 |
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InChI Key | VOKJVDXYGGTMSP-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 | heteroaromatic compoundshydrocarbon derivativesorganic cationsoxacyclic compounds |
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Substituents | oxacyclearomatic heteromonocyclic compoundheteroaromatic compoundhydrocarbon derivativeorganic cationalkyl aryl etherorganoheterocyclic compound |
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