| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 08:13:01 UTC |
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| Update Date | 2025-03-24 22:38:23 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01235246 |
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| Frequency | 1.1 |
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| Structure | |
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| Chemical Formula | C5H7NO |
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| Molecular Mass | 97.0528 |
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| SMILES | NCCC=C=C=O |
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| InChI Key | QNWNPCIUXNLSRK-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic nitrogen compounds |
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| Class | organonitrogen compounds |
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| Subclass | organonitrogen compounds |
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| Direct Parent | organonitrogen compounds |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | hydrocarbon derivativesmonoalkylaminesorganic oxidesorganooxygen compoundsorganopnictogen compounds |
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| Substituents | aliphatic acyclic compoundorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganooxygen compound |
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