| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:20:45 UTC |
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| Update Date | 2025-03-25 01:01:22 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02248828 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C17H17NO5 |
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| Molecular Mass | 315.1107 |
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| SMILES | COc1ccc(C2Nc3cc4c(cc3CC2O)OCO4)cc1O |
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| InChI Key | MKMJOPRYNOMDOO-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 benzenoids1-hydroxy-4-unsubstituted benzenoidsacetalsalkyl aryl ethersanisolesazacyclic compoundsbenzodioxoleshydrocarbon derivativeshydroquinolinesmethoxybenzenesmethoxyphenolsorganopnictogen compoundsoxacyclic compoundsphenoxy compoundssecondary alcoholssecondary alkylarylamines |
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| Substituents | phenol ethermonocyclic benzene moietyetherphenylquinoline1-hydroxy-2-unsubstituted benzenoidmethoxyphenolalkyl aryl etheracetalaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundtetrahydroquinolinebenzodioxolealcoholazacycle1-hydroxy-4-unsubstituted benzenoidsecondary aminemethoxybenzenesecondary aliphatic/aromatic amineoxacycleorganic oxygen compoundanisolesecondary alcoholphenolhydrocarbon derivativebenzenoidorganic nitrogen compoundphenoxy compoundamineorganooxygen compound |
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