| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:06:48 UTC |
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| Update Date | 2025-03-21 18:29:37 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00078540 |
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| Frequency | 43.9 |
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| Structure | |
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| Chemical Formula | C12H8N2O |
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| Molecular Mass | 196.0637 |
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| SMILES | O=c1[nH]c2ccccc2c2ccncc12 |
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| InChI Key | HPFOEWJXDNWCTH-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 | quinolones and derivatives |
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| Direct Parent | hydroquinolones |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesazacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativeshydroquinolineslactamsnaphthyridinesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspolyhalopyridinespyridines and derivativespyridinones |
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| Substituents | naphthyridinelactamazacyclepolyhalopyridineheteroaromatic compounddihydroquinolineorganic oxidedihydroquinolonepyridineorganic oxygen compounddiazanaphthalenearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoid2-halopyridineorganic nitrogen compoundpyridinoneorganooxygen compound |
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