| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:45:37 UTC |
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| Update Date | 2025-03-21 18:00:34 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00028111 |
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| Frequency | 134.3 |
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| Structure | |
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| Chemical Formula | C14H16O3 |
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| Molecular Mass | 232.1099 |
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| SMILES | O=CC(=Cc1ccccc1)CCCCC(=O)O |
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| InChI Key | VOBANBSHSPLTQQ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | phenylpropanoids and polyketides |
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| Class | cinnamaldehydes |
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| Subclass | cinnamaldehydes |
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| Direct Parent | cinnamaldehydes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | aldehydesbenzene and substituted derivativesbranched fatty acidscarbocyclic fatty acidscarboxylic acidsfatty acylshydrocarbon derivativesmedium-chain fatty acidsmonocarboxylic acids and derivativesorganic oxides |
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| Substituents | fatty acylcarbocyclic fatty acidmonocyclic benzene moietycinnamaldehydecarbonyl groupcarboxylic acidaldehydecarboxylic acid derivativebranched fatty acidaromatic homomonocyclic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativemedium-chain fatty acidbenzenoidorganooxygen compound |
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