Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:36:57 UTC |
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Update Date | 2025-03-21 17:57:31 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00008363 |
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Frequency | 586.7 |
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Structure | |
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Chemical Formula | C8H8O2 |
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Molecular Mass | 136.0524 |
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SMILES | O=CCc1ccccc1O |
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InChI Key | RFBOLEJBSGUBPZ-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 | phenylacetaldehydes |
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Direct Parent | phenylacetaldehydes |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsalpha-hydrogen aldehydeshydrocarbon derivativesorganic oxides |
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Substituents | carbonyl group1-hydroxy-2-unsubstituted benzenoidaldehyde1-hydroxy-4-unsubstituted benzenoidaromatic homomonocyclic compoundorganic oxideorganic oxygen compoundalpha-hydrogen aldehydephenolhydrocarbon derivativeorganooxygen compoundphenylacetaldehyde |
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