| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:39:35 UTC |
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| Update Date | 2025-03-25 00:46:22 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02154883 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H12N2O |
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| Molecular Mass | 188.095 |
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| SMILES | CC(=O)N1CCC(c2ccccc2)=N1 |
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| InChI Key | QDBXCEYPCFJLAZ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | benzene and substituted derivatives |
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| Direct Parent | benzene and substituted derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | acetamidesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrazolines |
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| Substituents | monocyclic benzene moietycarbonyl grouparomatic heteromonocyclic compoundazacyclecarboxylic acid derivativepyrazolineorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundacetamideorganooxygen compound |
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