| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:58:41 UTC |
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| Update Date | 2025-03-21 18:05:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00059052 |
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| Frequency | 53.3 |
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| Structure | |
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| Chemical Formula | C11H14O4 |
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| Molecular Mass | 210.0892 |
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| SMILES | COc1cc(CC=O)cc(OC)c1OC |
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| InChI Key | PDZYOCOHQGFKLC-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 | alkyl aryl ethersalpha-hydrogen aldehydesanisoleshydrocarbon derivativesmethoxybenzenesorganic oxidesphenoxy compounds |
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| Substituents | phenol ethercarbonyl groupetheraldehydealkyl aryl ethermethoxybenzenearomatic homomonocyclic compoundorganic oxideorganic oxygen compoundalpha-hydrogen aldehydeanisolehydrocarbon derivativephenoxy compoundorganooxygen compoundphenylacetaldehyde |
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