Record Information |
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HMDB Status | expected |
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Creation Date | 2024-02-21 00:27:13 UTC |
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Update Date | 2025-03-21 18:39:52 UTC |
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HMDB ID | HMDB0034666 |
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Metabolite Identification |
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DeepMet ID | DMID00127549 |
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Name | (±)-2-Hydroxy-2-phenylacetonitrile |
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Frequency | 20.0 |
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Structure | |
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Chemical Formula | C8H7NO |
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Molecular Mass | 133.0528 |
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SMILES | N#CC(O)c1ccccc1 |
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InChI Key | NNICRUQPODTGRU-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | benzenoids |
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Class | benzene and substituted derivatives |
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Subclass | benzene and substituted derivatives |
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Direct Parent | benzene and substituted derivatives |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | alpha-hydroxynitrilesaromatic alcoholscyanohydrinshydrocarbon derivativesorganonitrogen compoundsorganopnictogen compoundssecondary alcohols |
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Substituents | aromatic alcoholalcoholmonocyclic benzene moietynitrilecyanohydrinaromatic homomonocyclic compoundorganic oxygen compoundalpha-hydroxynitrileorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundcarbonitrileorganooxygen compound |
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