| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:39:00 UTC |
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| Update Date | 2025-03-25 00:46:08 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02153499 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H21NO |
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| Molecular Mass | 243.1623 |
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| SMILES | COc1ccc(C=C2CCC3CCC2N3C)cc1 |
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| InChI Key | XESJANDAKWPRIS-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | alkaloids and derivatives |
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| Class | tropane alkaloids |
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| Subclass | tropane alkaloids |
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| Direct Parent | tropane alkaloids |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkyl aryl ethersanisolesazacyclic compoundshydrocarbon derivativesmethoxybenzenesn-alkylpyrrolidinesorganopnictogen compoundsphenoxy compoundspiperidinestrialkylamines |
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| Substituents | phenol ethermonocyclic benzene moietyetheralkyl aryl etheraromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundpyrrolidinepiperidinetertiary amineorganoheterocyclic compoundazacyclen-alkylpyrrolidinetertiary aliphatic aminemethoxybenzeneorganic oxygen compoundanisolehydrocarbon derivativebenzenoidorganic nitrogen compoundphenoxy compoundtropane alkaloidamineorganooxygen compound |
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