| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:21:17 UTC |
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| Update Date | 2025-03-25 01:01:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02250052 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H18N2O6P+ |
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| Molecular Mass | 257.0897 |
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| SMILES | C[N+](C)(C)CCOP(=O)(O)OCC[N+](=O)[O-] |
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| InChI Key | OXCPFKJYOQLOAT-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 | phosphocholines |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | aminesc-nitro compoundsdialkyl phosphateshydrocarbon derivativesorganic cationsorganic oxidesorganic oxoanionic compoundsorganic oxoazanium compoundsorganic saltsorganooxygen compoundsorganopnictogen compoundstetraalkylammonium salts |
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| Substituents | aliphatic acyclic compoundtetraalkylammonium saltphosphocholineorganic nitro compounddialkyl phosphateorganic oxideorganic oxygen compoundphosphoric acid esterc-nitro compoundorganopnictogen compoundhydrocarbon derivativeorganic cationorganic oxoazaniumorganic saltorganic phosphoric acid derivativeaminealkyl phosphateorganooxygen compoundorganic hyponitrite |
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