| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:59:39 UTC |
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| Update Date | 2025-03-25 00:53:34 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02200479 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H11O4PS |
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| Molecular Mass | 246.0116 |
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| SMILES | COP(O)(=S)Oc1ccccc1C(C)=O |
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| InChI Key | PDECHNLMQSPFSV-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 | acetophenonesaryl alkyl ketonesbenzoyl derivativeshydrocarbon derivativesorganic oxidesorganooxygen compoundsphenoxy compoundsphenyl thiophosphatesthiophosphate diesters |
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| Substituents | monocyclic benzene moietyaryl alkyl ketonearyl thiophosphatethiophosphoric acid esterbenzoylphenyl thiophosphatethiophosphate diesteraromatic homomonocyclic compoundorganic thiophosphoric acid or derivativesorganic oxideacetophenonehydrocarbon derivativebenzenoidphenoxy compoundalkyl-phenylketone |
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