| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 03:49:54 UTC |
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| Update Date | 2025-03-21 22:58:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00604155 |
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| Frequency | 2.7 |
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| Structure | |
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| Chemical Formula | C6H8O2 |
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| Molecular Mass | 112.0524 |
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| SMILES | C=CC=CC(=O)CO |
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| InChI Key | XLQSSDLYYGGCKO-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | fatty acyls |
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| Subclass | fatty alcohols |
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| Direct Parent | fatty alcohols |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acryloyl compoundsalcohols and polyolsalpha-hydroxy ketonesenoneshydrocarbon derivativesorganic oxides |
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| Substituents | alcoholaliphatic acyclic compoundcarbonyl groupalpha,beta-unsaturated ketonealpha-hydroxy ketoneketoneorganic oxideorganic oxygen compoundfatty alcoholhydrocarbon derivativeacryloyl-grouporganooxygen compoundenone |
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