| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:15:22 UTC |
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| Update Date | 2025-03-25 00:59:19 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02236410 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H14N2O4+2 |
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| Molecular Mass | 178.0943 |
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| SMILES | C[N+](C)(C)C(CC(=O)O)[N+](=O)O |
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| InChI Key | YNXOJOVPPRXXBD-UHFFFAOYSA-O |
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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 | quaternary ammonium salts |
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| Direct Parent | tetraalkylammonium salts |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | c-nitro compoundscarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic cationsorganic oxidesorganic oxoanionic compoundsorganic oxoazanium compoundsorganic saltsorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidtetraalkylammonium saltcarboxylic acid derivativeorganic nitro compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundc-nitro compoundorganopnictogen compoundhydrocarbon derivativeorganic cationorganic oxoazaniumorganic saltorganooxygen compoundorganic hyponitrite |
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