| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:50:48 UTC |
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| Update Date | 2025-03-25 00:50:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02180342 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H24N2O8P+ |
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| Molecular Mass | 331.1265 |
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| SMILES | C[N+](C)(C)CCOP(=O)(O)OCC(O)C(O)C(N)C(=O)O |
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| InChI Key | FVFYIFRMBAHZKZ-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 | 1,2-diolsalpha amino acidsaminesbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acidsdialkyl phosphatesfatty acids and conjugateshydrocarbon derivativesmonoalkylaminesmonocarboxylic acids and derivativesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundssecondary alcoholsshort-chain hydroxy acids and derivativestetraalkylammonium salts |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidshort-chain hydroxy acidfatty acidalpha-amino acid or derivativescarboxylic acid derivativebeta-hydroxy acidorganic oxidealpha-amino acidorganopnictogen compoundorganic cationorganic salt1,2-diolalcoholtetraalkylammonium salthydroxy acidphosphocholinedialkyl phosphatemonocarboxylic acid or derivativesorganic oxygen compoundphosphoric acid estersecondary alcoholhydrocarbon derivativeprimary aliphatic amineorganic phosphoric acid derivativeaminealkyl phosphateorganooxygen compound |
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