| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 16:35:44 UTC |
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| Update Date | 2025-03-25 01:29:38 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02422010 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C5H9NO |
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| Molecular Mass | 99.0684 |
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| SMILES | C=C=CC(O)CN |
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| InChI Key | MSWJVUABKSOCRF-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | alcohols and polyols |
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| Direct Parent | secondary alcohols |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | hydrocarbon derivativesmonoalkylaminesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | aliphatic acyclic compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compound |
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