| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:59:27 UTC |
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| Update Date | 2025-03-25 00:53:29 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02199995 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H10Cl2N2O |
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| Molecular Mass | 316.017 |
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| SMILES | N#Cc1ccc2c(c1)NC(=O)CC2c1ccc(Cl)cc1Cl |
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| InChI Key | PPQRAUXMKIKHJR-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | quinolines and derivatives |
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| Subclass | phenylquinolines |
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| Direct Parent | phenylquinolines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | aryl chloridesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesdichlorobenzeneshydrocarbon derivativeshydroquinolineshydroquinoloneslactamsnitrilesorganic oxidesorganochloridesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amides |
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| Substituents | monocyclic benzene moietycarbonyl groupnitrilelactamphenylquinolineorganochloridecarboxylic acid derivativeorganohalogen compound1,3-dichlorobenzeneorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundtetrahydroquinolinecarbonitrilearyl chloridechlorobenzenequinolonetetrahydroquinoloneazacyclecarboxamide grouparyl halidesecondary carboxylic acid amideorganic oxygen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundhalobenzeneorganooxygen compound |
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