| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:45 UTC |
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| Update Date | 2025-03-25 00:47:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02159639 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H10N2O2 |
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| Molecular Mass | 214.0742 |
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| SMILES | O=CNc1ccc(Oc2cccnc2)cc1 |
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| InChI Key | LMDVGCAQBVXLOI-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 | diarylethers |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | anilidesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesn-arylamidesorganic oxidesorganopnictogen compoundsphenol ethersphenoxy compoundspyridines and derivativessecondary carboxylic acid amides |
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| Substituents | diaryl etherphenol ethermonocyclic benzene moietycarbonyl grouparomatic heteromonocyclic compoundn-arylamidecarboxylic acid derivativeorganic oxideorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compoundazacycleheteroaromatic compoundcarboxamide groupanilidesecondary carboxylic acid amidepyridinehydrocarbon derivativebenzenoidorganic nitrogen compoundphenoxy compound |
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