| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:20:47 UTC |
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| Update Date | 2025-03-25 01:01:23 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02248902 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H14N2O2 |
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| Molecular Mass | 206.1055 |
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| SMILES | COc1ccc(C(=O)N2CCCC2)cn1 |
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| InChI Key | KRYSIIGRZNAVRF-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 | pyridinecarboxylic acids and derivatives |
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| Direct Parent | pyridinecarboxylic acids and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2-halopyridinesalkyl aryl ethersazacyclic compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesmethylpyridinesn-acylpyrrolidinesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspolyhalopyridinestertiary carboxylic acid amides |
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| Substituents | pyridine carboxylic acid or derivativesetheraromatic heteromonocyclic compoundazacyclepolyhalopyridineheteroaromatic compoundn-acylpyrrolidinemethylpyridinealkyl aryl ethercarboxamide groupcarboxylic acid derivativeorganic oxideorganic oxygen compoundtertiary carboxylic acid amideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative2-halopyridineorganic nitrogen compoundpyrrolidineorganooxygen compound |
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