| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:14:45 UTC |
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| Update Date | 2025-03-25 00:59:06 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02235054 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C21H19Cl2N |
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| Molecular Mass | 355.0895 |
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| SMILES | CNC1CCC(c2ccc(Cl)c(Cl)c2)c2ccc3ccccc3c21 |
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| InChI Key | XPUPXQVCRBWKQI-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 | aryl chloridesdialkylaminesdichlorobenzeneshydrocarbon derivativesnaphthalenesorganochloridesorganopnictogen compoundsphenanthrenes and derivatives |
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| Substituents | aryl chloridechlorobenzenesecondary aliphatic aminemonocyclic benzene moietyphenanthreneorganochloridearomatic homopolycyclic compoundsecondary amineorganohalogen compoundaryl halidetametralinenaphthaleneorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative1,2-dichlorobenzeneorganic nitrogen compoundhalobenzeneamine |
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