| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:19:09 UTC |
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| Update Date | 2025-03-25 01:00:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02245144 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C22H23Cl2N3 |
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| Molecular Mass | 399.1269 |
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| SMILES | CNC(=N)N1CCC(=C2c3ccc(Cl)cc3CCc3cc(Cl)ccc32)CC1 |
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| InChI Key | OFHOCIGHYAEYER-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 heteropolycyclic compounds |
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| Alternative Parents | aryl chloridesazacyclic compoundscarboximidamidesguanidineshydrocarbon derivativesiminesorganochloridesorganopnictogen compoundspiperidines |
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| Substituents | aryl chlorideazacycleguanidineimineorganochloridecarboximidamideorganohalogen compounddibenzocycloheptenearyl halidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundpiperidineorganoheterocyclic compound |
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