| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:51:54 UTC |
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| Update Date | 2025-03-25 00:50:44 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02182834 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H10N2O2 |
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| Molecular Mass | 214.0742 |
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| SMILES | O=c1[nH]c2c(CO)c[nH]c2c2ccccc12 |
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| InChI Key | QOUNTVVZZQTMRJ-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 | isoquinolones and derivatives |
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| Direct Parent | isoquinolones and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesaromatic alcoholsazacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativeshydroxypyridineslactamsorganic oxidesorganonitrogen compoundsorganopnictogen compoundspolyhalopyridinespyridinonespyrroles |
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| Substituents | aromatic alcoholalcohollactamazacyclepolyhalopyridineheteroaromatic compoundhydroxypyridineorganic oxidepyridineorganic oxygen compoundaromatic heteropolycyclic compoundpyrroleorganonitrogen compoundorganopnictogen compoundisoquinolonehydrocarbon derivativebenzenoid2-halopyridineorganic nitrogen compoundpyridinoneorganooxygen compound |
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