| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:46:37 UTC |
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| Update Date | 2025-03-21 18:01:00 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00030410 |
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| Frequency | 122.3 |
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| Structure | |
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| Chemical Formula | C11H10N2O2 |
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| Molecular Mass | 202.0742 |
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| SMILES | O=C(NCc1ccco1)c1cccnc1 |
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| InChI Key | OLEYYNUSGLFIKE-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 | azacyclic compoundscarboxylic acids and derivativesfuransheteroaromatic compoundshydrocarbon derivativesnicotinamidesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsoxacyclic compoundssecondary carboxylic acid amides |
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| Substituents | pyridine carboxylic acid or derivativesfuranaromatic heteromonocyclic compoundazacyclenicotinamideheteroaromatic compoundcarboxamide groupcarboxylic acid derivativeoxacyclesecondary carboxylic acid amideorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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