| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:31:21 UTC |
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| Update Date | 2025-03-21 18:41:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00137149 |
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| Frequency | 18.2 |
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| Structure | |
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| Chemical Formula | C13H21NO3 |
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| Molecular Mass | 239.1521 |
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| SMILES | COc1cccc(OCC(O)CNC(C)C)c1 |
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| InChI Key | RRQYXQONBHYRKI-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 | phenol ethers |
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| Subclass | anisoles |
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| Direct Parent | anisoles |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alkyl aryl ethersdialkylamineshydrocarbon derivativesmethoxybenzenesorganopnictogen compoundsphenoxy compoundssecondary alcohols |
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| Substituents | alcoholsecondary aliphatic aminemonocyclic benzene moietyetheralkyl aryl ethersecondary aminemethoxybenzenearomatic homomonocyclic compoundorganic oxygen compoundanisoleorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundphenoxy compoundorganooxygen compoundamine |
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