| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:25 UTC |
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| Update Date | 2025-03-25 00:47:01 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02158913 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H11NO3 |
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| Molecular Mass | 265.0739 |
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| SMILES | Oc1cccc2c(-c3ccc4c(c3)OCO4)ccnc12 |
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| InChI Key | HLMRXQPOQRZAFX-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 | 8-hydroxyquinolines |
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| Direct Parent | 8-hydroxyquinolines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoids2-halopyridinesacetalsazacyclic compoundsbenzenoidsbenzodioxolesheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsoxacyclic compoundspolyhalopyridines |
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| Substituents | 8-hydroxyquinolineazacyclepolyhalopyridineheteroaromatic compoundhydroxypyridine1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidoxacyclepyridineorganic oxygen compoundacetalaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoid2-halopyridineorganic nitrogen compoundorganooxygen compoundbenzodioxole |
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