| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:17:39 UTC |
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| Update Date | 2025-03-25 01:00:13 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02241597 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H12NO5P |
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| Molecular Mass | 245.0453 |
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| SMILES | CC(N)C(=O)c1ccc(OP(=O)(O)O)cc1 |
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| InChI Key | JFIPWXILSBVZFH-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | alkyl-phenylketones |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | aryl alkyl ketonesbenzoyl derivativeshydrocarbon derivativesmonoalkylaminesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsphenoxy compoundsphenyl phosphatesphenylpropanes |
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| Substituents | monocyclic benzene moietyaryl alkyl ketonebenzoylphenylpropaneorganic oxideorganonitrogen compoundorganopnictogen compoundphenyl phosphatearomatic homomonocyclic compoundphosphoric acid esterhydrocarbon derivativearyl phosphomonoesterbenzenoidprimary aliphatic amineorganic nitrogen compoundphenoxy compoundaryl phosphateorganic phosphoric acid derivativealkyl-phenylketone |
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