| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:39:34 UTC |
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| Update Date | 2025-03-25 00:46:22 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02154847 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C17H21NO3 |
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| Molecular Mass | 287.1521 |
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| SMILES | COc1ccc(C(O)(CCCN)c2ccc(O)cc2)cc1 |
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| InChI Key | QCFAJOYSGIYUCK-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 | benzene and substituted derivatives |
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| Subclass | diphenylmethanes |
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| Direct Parent | diphenylmethanes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsalkyl aryl ethersanisolesaromatic alcoholshydrocarbon derivativesmethoxybenzenesmonoalkylaminesorganonitrogen compoundsorganopnictogen compoundsphenoxy compoundsphenylbutylaminestertiary alcohols |
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| Substituents | aromatic alcoholalcoholdiphenylmethanephenol etherether1-hydroxy-2-unsubstituted benzenoidalkyl aryl ethermethoxybenzenearomatic homomonocyclic compoundtertiary alcoholphenylbutylamineorganic oxygen compoundanisoleorganonitrogen compoundorganopnictogen compoundphenolhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundphenoxy compoundorganooxygen compound |
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