| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:50:18 UTC |
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| Update Date | 2025-03-25 00:50:10 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02179181 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H22NO+ |
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| Molecular Mass | 220.1696 |
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| SMILES | COc1ccc(C2C(C)CC[N+]2(C)C)cc1 |
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| InChI Key | DQJCUQNVXGJNAT-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | pyrrolidines |
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| Subclass | phenylpyrrolidines |
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| Direct Parent | phenylpyrrolidines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alkyl aryl ethersanisolesaralkylaminesazacyclic compoundshydrocarbon derivativesmethoxybenzenesn-alkylpyrrolidinesorganic cationsorganic saltsorganopnictogen compoundsphenoxy compoundspyrrolestetraalkylammonium salts |
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| Substituents | phenol ethermonocyclic benzene moietyetheraromatic heteromonocyclic compoundalkyl aryl etheraralkylamineorganonitrogen compoundorganopnictogen compoundorganic cationorganic salttetraalkylammonium saltazacyclen-alkylpyrrolidine2-phenylpyrrolidinequaternary ammonium saltmethoxybenzeneorganic oxygen compoundanisolepyrrolehydrocarbon derivativebenzenoidorganic nitrogen compoundphenoxy compoundamineorganooxygen compound |
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