| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:54:54 UTC |
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| Update Date | 2025-03-21 18:04:23 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00050276 |
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| Frequency | 65.3 |
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| Structure | |
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| Chemical Formula | C22H22ClNO2 |
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| Molecular Mass | 367.1339 |
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| SMILES | CCOC(=O)N1CCC(=C2c3ccccc3Cc3cc(Cl)ccc32)CC1 |
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| InChI Key | VWRCSBDJLNSEBY-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 | anthracenes |
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| Subclass | anthracenes |
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| Direct Parent | anthracenes |
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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 oxidesorganochloridesorganonitrogen compoundsorganopnictogen compoundspiperidinecarboxylic acidspiperidines |
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| Substituents | aryl chlorideanthracenecarbonyl groupcarbonic acid derivativeazacycleorganochloridecarbamic acid esterorganohalogen compoundaryl halideorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativepiperidinecarboxylic acidorganic nitrogen compoundpiperidineorganoheterocyclic compoundorganooxygen compound |
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