| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:49:46 UTC |
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| Update Date | 2025-03-25 00:49:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02178005 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H24N2O6P+ |
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| Molecular Mass | 335.1366 |
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| SMILES | Cc1ncc(COP(=O)(O)OCC[N+](C)(C)C)c(CO)c1O |
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| InChI Key | CQBKXLCKNPAXNX-UHFFFAOYSA-O |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | pyridines and derivatives |
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| Subclass | pyridoxines |
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| Direct Parent | pyridoxines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2-halopyridinesaminesaromatic alcoholsazacyclic compoundsdialkyl phosphatesheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmethylpyridinesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundsphosphocholinespolyhalopyridinestetraalkylammonium salts |
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| Substituents | aromatic alcoholaromatic heteromonocyclic compoundpolyhalopyridineorganic oxideorganonitrogen compoundorganopnictogen compound2-halopyridineorganic cationorganic saltalcoholtetraalkylammonium saltazacyclequaternary ammonium saltheteroaromatic compoundhydroxypyridinemethylpyridinepyridoxinephosphocholinedialkyl phosphateorganic oxygen compoundphosphoric acid esterhydrocarbon derivativeorganic nitrogen compoundorganic phosphoric acid derivativeaminealkyl phosphateorganooxygen compound |
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