| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:13:20 UTC |
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| Update Date | 2025-03-25 00:58:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02231762 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C17H14FN |
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| Molecular Mass | 251.111 |
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| SMILES | CC1(c2ccc(F)cc2)CCc2ccc(C#N)cc21 |
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| InChI Key | OHGPELZBAGVFAS-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 | indanes |
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| Subclass | indanes |
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| Direct Parent | indanes |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | aryl fluoridesfluorobenzeneshydrocarbon derivativesnitrilesorganofluoridesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | aryl fluoridemonocyclic benzene moietynitrileorganofluoridearomatic homopolycyclic compoundorganohalogen compoundaryl halidefluorobenzeneindaneorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundhalobenzenecarbonitrile |
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