| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:13:13 UTC |
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| Update Date | 2025-03-25 00:58:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02231482 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C21H27NO10 |
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| Molecular Mass | 453.1635 |
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| SMILES | CC1OC(OCC2OC(Oc3ccc4cccnc4c3)C(O)C(O)C2O)C(O)C(O)C1O |
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| InChI Key | OJMZQSYIRHSTKJ-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 | quinolines and derivatives |
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| Direct Parent | quinolines and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesacetalsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmethylpyridinesmonosaccharidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanesphenol etherspolyhalopyridinessecondary alcohols |
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| Substituents | phenol etherpolyhalopyridinemonosaccharidesaccharideacetalaromatic heteropolycyclic compoundorganonitrogen compoundquinolineorganopnictogen compound2-halopyridineoxanealcoholazacycleheteroaromatic compoundhydroxypyridinemethylpyridineoxacyclepyridineorganic oxygen compoundsecondary alcoholhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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