| Record Information |
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| HMDB Status | expected |
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| Creation Date | 2024-02-20 23:57:08 UTC |
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| Update Date | 2025-03-21 18:05:11 UTC |
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| HMDB ID | HMDB0014021 |
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| Metabolite Identification |
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| DeepMet ID | DMID00055379 |
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| Name | N-Desmethylcitalopram |
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| Frequency | 57.8 |
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| Structure | |
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| Chemical Formula | C19H19FN2O |
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| Molecular Mass | 310.1481 |
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| SMILES | CNCCCC1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 |
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| InChI Key | PTJADDMMFYXMMG-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 heteropolycyclic compounds |
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| Alternative Parents | aryl fluoridesdialkyl ethersdialkylaminesfluorobenzeneshydrocarbon derivativesisocoumaransnitrilesorganofluoridesorganopnictogen compoundsoxacyclic compounds |
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| Substituents | aryl fluorideethernitrileorganohalogen compounddialkyl etherfluorobenzenephenylbutylamineisocoumaranaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundcarbonitrileorganoheterocyclic compoundsecondary aliphatic amineorganofluoridesecondary aminearyl halideoxacycleorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundhalobenzeneorganooxygen compoundamine |
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