| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:20:44 UTC |
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| Update Date | 2025-03-21 18:36:45 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00112132 |
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| Frequency | 23.7 |
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| Structure | |
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| Chemical Formula | C18H20FN |
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| Molecular Mass | 269.158 |
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| SMILES | NCCCC1(c2ccc(F)cc2)CCc2ccccc21 |
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| InChI Key | XPXRDLQOINWPFA-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 | phenylbutylamines |
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| Direct Parent | phenylbutylamines |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | aryl fluoridesfluorobenzeneshydrocarbon derivativesindanesmonoalkylaminesorganofluoridesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | aryl fluorideorganofluoridearomatic homopolycyclic compoundorganohalogen compoundaryl halidefluorobenzenephenylbutylamineindaneorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundhalobenzene |
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