| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:56:43 UTC |
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| Update Date | 2025-03-25 00:52:26 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02193713 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C25H29ClN2O2 |
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| Molecular Mass | 424.1918 |
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| SMILES | CN(C)CCOC(=O)N1CCC(=C2c3ccccc3CCc3cc(Cl)ccc32)CC1 |
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| InChI Key | KJFOTIHKRABIKA-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 | dibenzocycloheptenes |
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| Subclass | dibenzocycloheptenes |
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| Direct Parent | dibenzocycloheptenes |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | aryl chloridesazacyclic compoundscarbamate esterscarbonyl compoundshydrocarbon derivativesorganic carbonic acids and derivativesorganic oxidesorganochloridesorganopnictogen compoundspiperidinecarboxylic acidspiperidinestrialkylamines |
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| Substituents | carbonyl grouporganochlorideorganohalogen compoundorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundpiperidinecarboxylic acidpiperidinetertiary amineorganoheterocyclic compoundaryl chloridecarbonic acid derivativeazacycletertiary aliphatic aminecarbamic acid esterdibenzocycloheptenearyl halideorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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