| Record Information |
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| HMDB Status | detected |
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| Creation Date | 2024-02-21 06:11:25 UTC |
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| Update Date | 2025-03-24 16:42:42 UTC |
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| HMDB ID | HMDB0250611 |
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| Metabolite Identification |
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| DeepMet ID | DMID00941736 |
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| Name | Cyanohydroxybutene |
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| Frequency | 1.5 |
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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 | CCC=C(O)C#N |
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| InChI Key | WJTPWAHVZOSBBG-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 | organic cyanides |
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| Direct Parent | cyanohydrins |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha-hydroxynitrileshydrocarbon derivativesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compounds |
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| Substituents | aliphatic acyclic compoundorganic oxygen compoundalpha-hydroxynitrileorganopnictogen compoundhydrocarbon derivativecyanohydrinorganooxygen compound |
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