| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:50:37 UTC |
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| Update Date | 2025-03-25 00:50:16 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02179888 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C18H23NO5 |
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| Molecular Mass | 333.1576 |
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| SMILES | COc1cc(CC(CO)C(CO)Cc2ccc(O)nc2)ccc1O |
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| InChI Key | NDPRFPOESRLATF-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | phenols |
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| Subclass | methoxyphenols |
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| Direct Parent | methoxyphenols |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids2-halopyridinesalkyl aryl ethersanisolesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmethoxybenzenesmethylpyridinesorganonitrogen compoundsorganopnictogen compoundsphenoxy compoundspolyhalopyridinesprimary alcohols |
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| Substituents | phenol ethermonocyclic benzene moietyetheraromatic heteromonocyclic compoundpolyhalopyridine1-hydroxy-2-unsubstituted benzenoidmethoxyphenolalkyl aryl etherorganonitrogen compoundorganopnictogen compound2-halopyridineprimary alcoholorganoheterocyclic compoundalcoholazacycleheteroaromatic compoundhydroxypyridinemethylpyridinemethoxybenzenepyridineorganic oxygen compoundanisolehydrocarbon derivativeorganic nitrogen compoundphenoxy compoundorganooxygen compound |
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