| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:25:21 UTC |
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| Update Date | 2025-03-21 18:38:55 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00123168 |
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| Frequency | 21.0 |
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| Structure | |
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| Chemical Formula | C29H32F3NO2 |
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| Molecular Mass | 483.2385 |
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| SMILES | OC(CCCN1CCC(C(O)(c2ccccc2)c2ccccc2)CC1)c1cccc(C(F)(F)F)c1 |
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| InChI Key | NPDPQGJXMOTKHG-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 | alkyl fluoridesaromatic alcoholsazacyclic compoundshydrocarbon derivativesorganofluoridesorganopnictogen compoundsphenylbutylaminespiperidinessecondary alcoholstertiary alcoholstrialkylaminestrifluoromethylbenzenes |
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| Substituents | aromatic alcoholdiphenylmethanearomatic heteromonocyclic compoundorganohalogen compoundphenylbutylamineorganonitrogen compoundorganopnictogen compoundalkyl halidepiperidinetrifluoromethylbenzenetertiary amineorganoheterocyclic compoundalcoholazacyclealkyl fluorideorganofluoridetertiary aliphatic aminetertiary alcoholorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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