| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:50:24 UTC |
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| Update Date | 2025-03-25 00:50:12 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02179410 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H18NO6+ |
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| Molecular Mass | 272.1129 |
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| SMILES | COc1ccc[n+](C2OC(CO)C(O)C(O)C2O)c1 |
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| InChI Key | QDPXJUFZLDQRDM-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 derivativeshydroxypyridinesmethylpyridinesmonosaccharidesorganic cationsorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanesprimary alcoholssecondary alcohols |
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| Substituents | alcoholaromatic heteromonocyclic compoundazacycleheteroaromatic compoundhydroxypyridinemonosaccharidemethylpyridinealkyl aryl etheroxacyclesaccharidepyridineorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cationoxaneprimary alcoholorganoheterocyclic compound |
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