| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:08:51 UTC |
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| Update Date | 2025-03-25 00:56:58 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02221832 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H18N2O4 |
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| Molecular Mass | 302.1267 |
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| SMILES | OCC(O)C(O)C(O)Cn1ccc2cc3ccccc3nc21 |
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| InChI Key | NAMOQZILJQMOOZ-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 | pyrroloquinolines |
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| Direct Parent | pyrroloquinolines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesazacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesorganonitrogen compoundsorganopnictogen compoundspolyhalopyridinesprimary alcoholspyrrolopyridinessecondary alcoholssubstituted pyrroles |
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| Substituents | alcoholpyrroloquinolineazacyclepyrrolopyridinepolyhalopyridineheteroaromatic compoundhydroxypyridinesubstituted pyrrolepyridineorganic oxygen compoundaromatic heteropolycyclic compoundpyrroleorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativebenzenoid2-halopyridineorganic nitrogen compoundprimary alcoholorganooxygen compound |
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