| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:05:12 UTC |
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| Update Date | 2025-03-25 00:55:38 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02213406 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C26H24Cl2N2 |
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| Molecular Mass | 434.1317 |
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| SMILES | CN(C)CCCC1(c2ccc(Cl)c(Cl)c2)c2ccccc2Cc2cc(C#N)ccc21 |
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| InChI Key | VLHGODSHWNUCCT-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 | anthracenes |
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| Subclass | anthracenes |
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| Direct Parent | anthracenes |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | aryl chloridesdichlorobenzeneshydrocarbon derivativesnitrilesorganochloridesorganopnictogen compoundsphenylbutylaminestrialkylamines |
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| Substituents | aryl chloridechlorobenzeneanthracenemonocyclic benzene moietynitrileorganochloridetertiary aliphatic aminearomatic homopolycyclic compoundorganohalogen compoundaryl halidephenylbutylamineorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative1,2-dichlorobenzeneorganic nitrogen compoundhalobenzeneaminecarbonitriletertiary amine |
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