| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 10:30:36 UTC |
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| Update Date | 2025-03-24 20:47:08 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01563993 |
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| Frequency | 0.8 |
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| Structure | |
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| Chemical Formula | C4H9NO |
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| Molecular Mass | 87.0684 |
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| SMILES | C=CC(C)(N)O |
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| InChI Key | KQBFGTMSTBSFTM-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 | amines |
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| Direct Parent | alkanolamines |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | hydrocarbon derivativesmonoalkylaminesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compounds |
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| Substituents | aliphatic acyclic compoundorganic oxygen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganooxygen compoundalkanolamine |
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