| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:49:36 UTC |
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| Update Date | 2025-03-25 00:49:56 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02177617 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H6ClN |
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| Molecular Mass | 187.0189 |
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| SMILES | N#Cc1cc2ccccc2cc1Cl |
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| InChI Key | ZLGGPHAGXMGBFW-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 | naphthalenes |
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| Subclass | chloronaphthalenes |
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| Direct Parent | chloronaphthalenes |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | aryl chlorideshydrocarbon derivativesnitrilesorganochloridesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | aryl chloridenitrileorganochloridechloronaphthalenearomatic homopolycyclic compoundorganohalogen compoundaryl halideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundcarbonitrile |
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