| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 08:31:19 UTC |
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| Update Date | 2025-03-25 00:19:17 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01279148 |
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| Frequency | 1.0 |
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| Structure | |
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| Chemical Formula | C4H9N2O3+ |
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| Molecular Mass | 133.0608 |
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| SMILES | NC(=O)CCC[N+](=O)O |
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| InChI Key | RIMKMRFZKSPRNV-UHFFFAOYSA-O |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | fatty acyls |
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| Subclass | fatty amides |
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| Direct Parent | fatty amides |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | c-nitro compoundscarbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganic oxoanionic compoundsorganic oxoazanium compoundsorganonitrogen compoundsorganopnictogen compoundsprimary carboxylic acid amidespropargyl-type 1,3-dipolar organic compounds |
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| Substituents | primary carboxylic acid amidealiphatic acyclic compoundcarbonyl groupallyl-type 1,3-dipolar organic compoundfatty amideorganic 1,3-dipolar compoundcarboxamide groupcarboxylic acid derivativeorganic nitro compoundpropargyl-type 1,3-dipolar organic compoundorganic oxideorganic oxygen compoundc-nitro compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic oxoazaniumorganooxygen compoundorganic hyponitrite |
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