| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:15:22 UTC |
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| Update Date | 2025-03-21 18:34:03 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00098941 |
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| Frequency | 27.8 |
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| Structure | |
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| Chemical Formula | C16H16ClN |
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| Molecular Mass | 257.0971 |
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| SMILES | CNC1c2ccccc2CCc2cc(Cl)ccc21 |
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| InChI Key | KNPDQRCBSBBUAH-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 | dibenzocycloheptenes |
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| Subclass | dibenzocycloheptenes |
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| Direct Parent | dibenzocycloheptenes |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | aryl chloridesdialkylamineshydrocarbon derivativesorganochloridesorganopnictogen compounds |
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| Substituents | aryl chloridesecondary aliphatic amineorganochloridearomatic homopolycyclic compoundsecondary amineorganohalogen compounddibenzocycloheptenearyl halideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundamine |
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