| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:56:40 UTC |
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| Update Date | 2025-03-25 00:52:25 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02193625 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H18N2O2 |
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| Molecular Mass | 210.1368 |
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| SMILES | CCc1nc(C)c(O)c(CN)c1CCO |
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| InChI Key | HCUJYMHDTUHYNX-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 | pyridines and derivatives |
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| Subclass | halopyridines |
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| Direct Parent | polyhalopyridines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2-halopyridinesalcohols and polyolsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmethylpyridinesmonoalkylaminesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | alcoholaromatic heteromonocyclic compoundazacyclepolyhalopyridineheteroaromatic compoundhydroxypyridinemethylpyridineorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amine2-halopyridineorganic nitrogen compoundorganooxygen compound |
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