Record Information |
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HMDB Status | expected |
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Creation Date | 2024-02-20 23:35:16 UTC |
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Update Date | 2025-03-21 17:56:55 UTC |
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HMDB ID | HMDB0013035 |
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Metabolite Identification |
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DeepMet ID | DMID00004491 |
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Name | Paraoxon |
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Frequency | 1251.4 |
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Structure | |
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Chemical Formula | C10H14NO6P |
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Molecular Mass | 275.0559 |
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SMILES | CCOP(=O)(OCC)Oc1ccc([N+](=O)[O-])cc1 |
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InChI Key | WYMSBXTXOHUIGT-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | organic acids and derivatives |
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Class | organic phosphoric acids and derivatives |
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Subclass | phosphate esters |
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Direct Parent | aryl dialkyl phosphates |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | dialkyl phosphateshydrocarbon derivativesnitroaromatic compoundsnitrobenzenesorganic oxidesorganic oxoanionic compoundsorganic oxoazanium compoundsorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsphenoxy compoundspropargyl-type 1,3-dipolar organic compounds |
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Substituents | monocyclic benzene moietyallyl-type 1,3-dipolar organic compoundorganic nitro compoundpropargyl-type 1,3-dipolar organic compoundorganic oxidearyl dialkyl phosphatec-nitro compoundorganonitrogen compoundorganopnictogen compoundorganic oxoazaniumnitrobenzenenitroaromatic compoundorganic 1,3-dipolar compoundaromatic homomonocyclic compounddialkyl phosphateorganic oxygen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundphenoxy compoundorganooxygen compoundorganic hyponitrite |
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