| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:01:36 UTC |
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| Update Date | 2025-03-21 18:06:55 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00065962 |
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| Frequency | 46.3 |
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| Structure | |
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| Chemical Formula | C16H27NO3 |
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| Molecular Mass | 281.1991 |
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| SMILES | CC(C)NCC(O)COc1ccc(O)c(C(C)(C)C)c1 |
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| InChI Key | VLLLIOHIGNCTDN-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 | 4-alkoxyphenols |
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| Direct Parent | 4-alkoxyphenols |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsalkyl aryl ethersdialkylamineshydrocarbon derivativesorganopnictogen compoundsphenol ethersphenoxy compoundsphenylpropanessecondary alcohols |
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| Substituents | alcoholphenol ethersecondary aliphatic aminemonocyclic benzene moiety4-alkoxyphenolether1-hydroxy-2-unsubstituted benzenoidalkyl aryl ethersecondary aminephenylpropanearomatic homomonocyclic compoundorganic oxygen compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundphenoxy compoundorganooxygen compoundamine |
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