| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:13:14 UTC |
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| Update Date | 2025-03-25 00:58:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02231533 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H18O2 |
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| Molecular Mass | 218.1307 |
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| SMILES | CC=C(C=O)c1ccc(CC(C)(C)O)cc1 |
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| InChI Key | HREZQLUQZXKTOO-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 | aldehydeshydrocarbon derivativesorganic oxidesphenylpropanestertiary alcohols |
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| Substituents | alcoholcarbonyl groupaldehydephenylpropanearomatic homomonocyclic compoundtertiary alcoholorganic oxideorganic oxygen compoundhydrocarbon derivativeorganooxygen compoundphenylacetaldehyde |
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