| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:22:05 UTC |
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| Update Date | 2025-03-25 01:01:49 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02251904 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H11NO7S |
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| Molecular Mass | 349.0256 |
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| SMILES | O=c1c(-c2ccc(O)cc2)c(O)[nH]c2c(OS(=O)(=O)O)cccc12 |
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| InChI Key | GSITUGVXHQRFQE-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 | phenylquinolines |
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| Direct Parent | phenylquinolines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids2-halopyridinesarylsulfatesazacyclic compoundsbenzene and substituted derivativesheteroaromatic compoundshydrocarbon derivativeshydroquinolineshydroquinoloneshydroxypyridinesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspolyhalopyridinessulfuric acid monoestersvinylogous acidsvinylogous amides |
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| Substituents | monocyclic benzene moietysulfuric acid monoesterphenylquinolinepolyhalopyridine1-hydroxy-2-unsubstituted benzenoidorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundarylsulfate2-halopyridinevinylogous amidequinoloneorganic sulfuric acid or derivativesazacycleheteroaromatic compoundhydroxypyridinedihydroquinolinevinylogous aciddihydroquinolonepyridineorganic oxygen compoundsulfate-esterphenolhydrocarbon derivativebenzenoidorganic nitrogen compoundsulfuric acid esterorganooxygen compound |
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