| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 11:01:41 UTC |
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| Update Date | 2025-03-24 20:59:53 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01637697 |
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| Frequency | 0.8 |
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| Structure | |
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| Chemical Formula | C5H12NO2+ |
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| Molecular Mass | 118.0863 |
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| SMILES | CC(O)C(C)[N+](C)=O |
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| InChI Key | QQNYCGLLWMCDDV-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 | aminoxideshydrocarbon derivativesorganic cationsorganic oxidesorganic oxoazanium compoundsorganopnictogen compounds |
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| Substituents | aliphatic acyclic compoundorganic oxideaminoxideorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cationorganic oxoazanium |
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