| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:12:16 UTC |
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| Update Date | 2025-03-21 18:32:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00091430 |
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| Frequency | 37.4 |
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| Structure | |
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| Chemical Formula | C9H12N2O |
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| Molecular Mass | 164.095 |
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| SMILES | Oc1ccc(C2CCCN2)cn1 |
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| InChI Key | CELSHJKHNJIAAJ-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 | pyrrolidinylpyridines |
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| Direct Parent | pyrrolidinylpyridines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2-halopyridinesazacyclic compoundsdialkylaminesheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesorganooxygen compoundsorganopnictogen compoundspolyhalopyridinespyrrolidines |
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| Substituents | secondary aliphatic aminearomatic heteromonocyclic compoundazacyclepyrrolidinylpyridinepolyhalopyridineheteroaromatic compoundhydroxypyridinesecondary amineorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative2-halopyridineorganic nitrogen compoundpyrrolidineorganooxygen compoundamine |
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