| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:49:26 UTC |
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| Update Date | 2025-03-25 00:49:53 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02177229 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H14FN3 |
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| Molecular Mass | 231.1172 |
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| SMILES | Fc1ccc(-c2nc(C3CCCN3)c[nH]2)cc1 |
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| InChI Key | PHXTVGPZWUXQAF-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | azoles |
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| Subclass | imidazoles |
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| Direct Parent | phenylimidazoles |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | aryl fluoridesazacyclic compoundsdialkylaminesfluorobenzenesheteroaromatic compoundshydrocarbon derivativesimidazolesorganofluoridesorganopnictogen compoundspyrrolidines |
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| Substituents | aryl fluoridesecondary aliphatic aminemonocyclic benzene moietyaromatic heteromonocyclic compoundazacycleorganofluorideheteroaromatic compoundsecondary amineorganohalogen compoundaryl halidefluorobenzene2-phenylimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundhalobenzenepyrrolidineamine |
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