| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:47:19 UTC |
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| Update Date | 2025-03-21 18:01:18 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00032113 |
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| Frequency | 114.0 |
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| Structure | |
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| Chemical Formula | C18H18N2 |
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| Molecular Mass | 262.147 |
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| SMILES | CNC1CCC(c2ccc(C#N)cc2)c2ccccc21 |
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| InChI Key | LWUGCEAWRIXREH-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 | tetralins |
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| Subclass | tametralines |
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| Direct Parent | tametralines |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | benzonitrilesdialkylamineshydrocarbon derivativesnitrilesorganopnictogen compounds |
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| Substituents | secondary aliphatic aminemonocyclic benzene moietynitrilearomatic homopolycyclic compoundsecondary aminebenzonitriletametralineorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundcarbonitrileamine |
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