| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:15:48 UTC |
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| Update Date | 2025-03-21 18:34:16 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00099997 |
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| Frequency | 27.4 |
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| Structure | |
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| Chemical Formula | C13H19NO2 |
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| Molecular Mass | 221.1416 |
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| SMILES | COc1ccc(C(O)C2CCCN2C)cc1 |
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| InChI Key | GFPTXASIEXYMQU-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 heteromonocyclic compounds |
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| Alternative Parents | 1,2-aminoalcoholsalkyl aryl ethersaromatic alcoholsazacyclic compoundshydrocarbon derivativesmethoxybenzenesn-alkylpyrrolidinesorganopnictogen compoundsphenoxy compoundssecondary alcoholstrialkylamines |
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| Substituents | aromatic alcoholmonocyclic benzene moietyetheraromatic heteromonocyclic compoundalkyl aryl etherorganonitrogen compoundorganopnictogen compoundpyrrolidinetertiary amineorganoheterocyclic compoundalcoholazacyclen-alkylpyrrolidine1,2-aminoalcoholtertiary aliphatic aminemethoxybenzeneorganic oxygen compoundanisolesecondary alcoholhydrocarbon derivativeorganic nitrogen compoundphenoxy compoundamineorganooxygen compound |
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