| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:47:44 UTC |
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| Update Date | 2025-03-21 18:01:28 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00033105 |
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| Frequency | 109.8 |
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| Structure | |
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| Chemical Formula | C13H16O |
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| Molecular Mass | 188.1201 |
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| SMILES | CCCCC(=O)C=Cc1ccccc1 |
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| InChI Key | FXQWBEDPJCDXQM-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 | cinnamic acids and derivatives |
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| Subclass | cinnamic acids and derivatives |
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| Direct Parent | cinnamic acids and derivatives |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | acryloyl compoundsbenzene and substituted derivativesenoneshydrocarbon derivativesketonesorganic oxides |
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| Substituents | monocyclic benzene moietycarbonyl groupalpha,beta-unsaturated ketoneketonearomatic homomonocyclic compoundcinnamic acid or derivativesorganic oxideorganic oxygen compoundhydrocarbon derivativebenzenoidacryloyl-grouporganooxygen compoundenone |
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