| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:12:37 UTC |
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| Update Date | 2025-03-25 00:58:20 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02230102 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H18O2 |
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| Molecular Mass | 206.1307 |
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| SMILES | CCCCCC(C=O)c1cccc(O)c1 |
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| InChI Key | NKLWYDRSGNNMTD-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 benzenoidsaldehydeshydrocarbon derivativesorganic oxides |
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| Substituents | carbonyl group1-hydroxy-2-unsubstituted benzenoidaldehyde1-hydroxy-4-unsubstituted benzenoidaromatic homomonocyclic compoundorganic oxideorganic oxygen compoundphenolhydrocarbon derivativeorganooxygen compoundphenylacetaldehyde |
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