| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 01:12:25 UTC |
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| Update Date | 2025-03-21 19:06:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00232873 |
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| Frequency | 9.2 |
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| Structure | |
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| Chemical Formula | C6H6O3 |
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| Molecular Mass | 126.0317 |
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| SMILES | COc1coc(C=O)c1 |
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| InChI Key | ICBJXPCILFXJID-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 | aryl-aldehydesfuransheteroaromatic compoundshydrocarbon derivativesorganic oxidesoxacyclic compounds |
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| Substituents | furanaromatic heteromonocyclic compoundheteroaromatic compoundaldehydealkyl aryl etheroxacycleorganic oxidearyl-aldehydehydrocarbon derivativeorganoheterocyclic compound |
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