| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:48 UTC |
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| Update Date | 2025-03-25 00:47:08 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02159756 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H7NO3 |
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| Molecular Mass | 189.0426 |
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| SMILES | O=c1c(O)c(O)ccc2ncccc12 |
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| InChI Key | PAEMITWSIHTKSE-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | hydrocarbon derivatives |
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| Class | tropones |
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| Subclass | tropolones |
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| Direct Parent | tropolones |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesazacyclic compoundsheteroaromatic compoundshydroxypyridinesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspolyhalopyridinesvinylogous acids |
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| Substituents | azacyclepolyhalopyridineheteroaromatic compoundhydroxypyridinetropolonevinylogous acidorganic oxidepyridineorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridineorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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