| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:59:53 UTC |
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| Update Date | 2025-03-21 18:06:13 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00061949 |
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| Frequency | 50.2 |
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| Structure | |
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| Chemical Formula | C17H23NO4 |
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| Molecular Mass | 305.1627 |
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| SMILES | C=CC1(O)CN2CCC1CC2C(O)c1ccc(O)c(OC)c1 |
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| InChI Key | WBRVUYBBVLTQAP-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 | methoxyphenols |
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| Direct Parent | methoxyphenols |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1,2-aminoalcohols1-hydroxy-2-unsubstituted benzenoidsalkyl aryl ethersanisolesaromatic alcoholsazacyclic compoundshydrocarbon derivativesmethoxybenzenesorganopnictogen compoundsphenoxy compoundspiperidinesquinuclidinessecondary alcoholstertiary alcoholstrialkylamines |
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| Substituents | aromatic alcoholphenol ethermonocyclic benzene moietyetherquinuclidine1-hydroxy-2-unsubstituted benzenoidmethoxyphenolalkyl aryl etheraromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundpiperidinetertiary amineorganoheterocyclic compoundalcoholazacycle1,2-aminoalcoholtertiary aliphatic aminemethoxybenzenetertiary alcoholorganic oxygen compoundanisolesecondary alcoholhydrocarbon derivativeorganic nitrogen compoundphenoxy compoundamineorganooxygen compound |
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