| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:37:18 UTC |
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| Update Date | 2025-03-21 17:57:38 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00009189 |
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| Frequency | 526.7 |
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| Structure | |
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| Chemical Formula | C13H21NO2 |
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| Molecular Mass | 223.1572 |
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| SMILES | Cc1ccc(OCC(O)CNC(C)C)cc1 |
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| InChI Key | MJXGIIVJTPVZCW-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 | phenol ethers |
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| Direct Parent | phenol ethers |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alkyl aryl ethersdialkylamineshydrocarbon derivativesorganopnictogen compoundsphenoxy compoundssecondary alcoholstoluenes |
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| Substituents | alcoholphenol ethersecondary aliphatic aminemonocyclic benzene moietyetheralkyl aryl ethersecondary aminearomatic homomonocyclic compoundorganic oxygen compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundphenoxy compoundtolueneorganooxygen compoundamine |
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