| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:38:09 UTC |
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| Update Date | 2025-03-25 00:45:49 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02151471 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C18H17FN2O |
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| Molecular Mass | 296.1325 |
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| SMILES | N#Cc1ccc2c(c1)OC(CCCN)(c1cccc(F)c1)C2 |
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| InChI Key | IEVJVDBCWIZDQV-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | phenylpropanoids and polyketides |
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| Class | 2-arylbenzofuran flavonoids |
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| Subclass | 2-arylbenzofuran flavonoids |
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| Direct Parent | 2-arylbenzofuran flavonoids |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkyl aryl ethersaryl fluoridescoumaransfluorobenzeneshydrocarbon derivativesmonoalkylaminesnitrilesorganofluoridesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsphenylbutylamines |
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| Substituents | aryl fluoridemonocyclic benzene moietyethernitrile2-arylbenzofuran flavonoidalkyl aryl etherorganohalogen compoundfluorobenzenephenylbutylaminearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundcarbonitrileorganoheterocyclic compoundcoumaranorganofluoridearyl halideoxacycleorganic oxygen compoundhydrocarbon derivativebenzenoidprimary aliphatic amineorganic nitrogen compoundhalobenzeneorganooxygen compound |
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