| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 01:50:09 UTC |
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| Update Date | 2025-03-21 20:04:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00319945 |
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| Frequency | 6.1 |
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| Structure | |
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| Chemical Formula | C7H10N2O |
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| Molecular Mass | 138.0793 |
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| SMILES | CN1C=CCC(C(N)=O)=C1 |
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| InChI Key | HOERLBZJYLYWEY-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 | n-substituted nicotinamides |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | amino acids and derivativesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesdihydropyridinesenamineshydrocarbon derivativesorganic oxidesorganopnictogen compoundsprimary carboxylic acid amidestrialkylaminesvinylogous amides |
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| Substituents | primary carboxylic acid amidevinylogous amidecarbonyl groupazacycleamino acid or derivativestertiary aliphatic aminecarboxamide groupcarboxylic acid derivativen-substituted nicotinamideorganic oxideorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compounddihydropyridineaminetertiary amineorganooxygen compoundenamine |
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