| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:19:21 UTC |
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| Update Date | 2025-03-21 18:36:05 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00108788 |
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| Frequency | 24.6 |
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| Structure | |
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| Chemical Formula | C14H12N+ |
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| Molecular Mass | 194.0964 |
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| SMILES | C[n+]1ccc2c(ccc3ccccc32)c1 |
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| InChI Key | MVXXJYWYOTWMNJ-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 | isoquinolines and derivatives |
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| Subclass | isoquinolines and derivatives |
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| Direct Parent | isoquinolines and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesnaphthalenesorganic cationsorganonitrogen compoundsorganopnictogen compoundspolyhalopyridinespyridines and derivatives |
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| Substituents | azacyclepolyhalopyridineheteroaromatic compoundpyridinenaphthalenearomatic heteropolycyclic compoundorganonitrogen compoundisoquinolineorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganic cation |
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