| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:49:34 UTC |
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| Update Date | 2025-03-21 18:02:20 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00037537 |
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| Frequency | 93.8 |
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| Structure | |
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| Chemical Formula | C28H31ClN2O2 |
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| Molecular Mass | 462.2074 |
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| SMILES | CN(C)C(=O)C(CCN1CCC(O)(c2ccc(Cl)cc2)C1)(c1ccccc1)c1ccccc1 |
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| InChI Key | RGXUFFVGLUGGBA-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 | diphenylmethanes |
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| Direct Parent | diphenylmethanes |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1,2-aminoalcoholsamino acids and derivativesaryl chloridesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativeschlorobenzeneshydrocarbon derivativesn-acyl aminesn-alkylpyrrolidinesorganic oxidesorganochloridesorganopnictogen compoundsphenylacetamidesphenylpyrrolidinespyrrolestertiary alcoholstertiary carboxylic acid amidestrialkylamines |
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| Substituents | diphenylmethanecarbonyl grouparomatic heteromonocyclic compoundamino acid or derivativesorganochloridecarboxylic acid derivativeorganohalogen compoundorganic oxidetertiary carboxylic acid amideorganonitrogen compoundorganopnictogen compoundpyrrolidinephenylacetamidetertiary amineorganoheterocyclic compoundaryl chloridechlorobenzenealcoholazacyclen-alkylpyrrolidine1,2-aminoalcoholtertiary aliphatic aminecarboxamide groupn-acyl-aminearyl halide3-phenylpyrrolidinetertiary alcoholorganic oxygen compoundpyrrolehydrocarbon derivativeorganic nitrogen compoundhalobenzeneamineorganooxygen compound |
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