| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:19:45 UTC |
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| Update Date | 2025-03-25 01:01:02 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02246574 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H12N2O3 |
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| Molecular Mass | 160.0848 |
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| SMILES | CCC(O)CCC(O)=NN=O |
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| InChI Key | HKAKJODSJVTIIW-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 nitroso compounds |
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| Direct Parent | nitrosimines |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | hydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary alcohols |
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| Substituents | alcoholaliphatic acyclic compoundorganic oxideorganic oxygen compoundnitrosiminesecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganooxygen compound |
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