Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:49:43 UTC |
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Update Date | 2025-03-21 18:02:25 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00037896 |
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Frequency | 92.6 |
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Structure | |
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Chemical Formula | C9H13NO3 |
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Molecular Mass | 183.0895 |
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SMILES | COc1cc(O)c(O)cc1CCN |
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InChI Key | CLNHHIHBDVMNJW-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 homomonocyclic compounds |
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Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids4-alkoxyphenolsalkyl aryl ethersanisoleshydrocarbon derivativesmethoxybenzenesmonoalkylaminesorganonitrogen compoundsorganopnictogen compoundsphenoxy compounds |
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Substituents | phenol ethermonocyclic benzene moiety4-alkoxyphenolethermethoxyphenol1-hydroxy-2-unsubstituted benzenoidalkyl aryl ethermethoxybenzenearomatic homomonocyclic compoundorganic oxygen compoundanisoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundphenoxy compoundorganooxygen compound |
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