| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:42:00 UTC |
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| Update Date | 2025-03-25 00:47:12 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02160176 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H12NO6P |
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| Molecular Mass | 273.0402 |
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| SMILES | Nc1ccccc1C(=O)CC(=O)COP(=O)(O)O |
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| InChI Key | VQALRBURCHFTJI-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 derivativesbutyrophenoneshydrocarbon derivativesmonoalkyl phosphatesorganic oxidesorganopnictogen compoundsprimary aminesvinylogous amides |
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| Substituents | monocyclic benzene moietyaryl alkyl ketonebenzoylorganic oxideorganonitrogen compoundorganopnictogen compoundvinylogous amidebutyrophenonearomatic homomonocyclic compoundphosphoric acid estermonoalkyl phosphatehydrocarbon derivativebenzenoidprimary amineorganic nitrogen compoundorganic phosphoric acid derivativeaminealkyl phosphatealkyl-phenylketone |
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