| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:49:22 UTC |
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| Update Date | 2025-03-25 00:49:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02177062 |
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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 | COc1ccc2c(c1)C1CCCC23CCN(C)C13 |
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| InChI Key | ZCIIQNPEDXRAJL-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 | benzene and substituted derivatives |
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| Subclass | benzazocines |
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| Direct Parent | benzazocines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkyl aryl ethersanisolesazacyclic compoundshydrocarbon derivativesindanesindolesn-alkylpyrrolidinesorganopnictogen compoundstrialkylamines |
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| Substituents | phenol etheretherazacyclen-alkylpyrrolidineindoletertiary aliphatic amineindole or derivativesalkyl aryl etherorganic oxygen compoundaromatic heteropolycyclic compoundanisolebenzazocineindaneorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundpyrrolidineaminetertiary amineorganoheterocyclic compoundorganooxygen compound |
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