| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:59:16 UTC |
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| Update Date | 2025-03-21 18:06:00 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00060455 |
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| Frequency | 51.8 |
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| Structure | |
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| Chemical Formula | C15H19N3O3 |
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| Molecular Mass | 289.1426 |
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| SMILES | COc1ccc2nccc(C(O)CCCN(C)N=O)c2c1 |
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| InChI Key | VBOJIDDVPYBSSL-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 | 4-quinolinemethanols |
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| Direct Parent | 4-quinolinemethanols |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesalkyl aryl ethersanisolesaromatic alcoholsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmethylpyridinesorganic n-nitroso compoundsorganic oxidesorganopnictogen compoundspolyhalopyridinessecondary alcohols |
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| Substituents | aromatic alcoholphenol etheretherpolyhalopyridinealkyl aryl etherorganic n-nitroso compoundorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridinealcoholorganic nitroso compoundazacycleheteroaromatic compoundhydroxypyridinemethylpyridine4-quinolinemethanolpyridineorganic oxygen compoundanisolesecondary alcoholhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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