| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 11:23:11 UTC |
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| Update Date | 2025-03-24 21:09:26 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01689956 |
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| Frequency | 0.7 |
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| Structure | |
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| Chemical Formula | C5H6O3 |
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| Molecular Mass | 114.0317 |
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| SMILES | CC(O)C(=O)C=C=O |
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| InChI Key | FMKFLDHFILMUIG-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | acyloins |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acryloyl compoundsalpha-hydroxy ketonesenoneshydrocarbon derivativesketenesorganic oxidessecondary alcoholsynolates |
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| Substituents | alcoholaliphatic acyclic compoundalpha-hydroxy ketoneketoneorganic oxideynolateacyloinsecondary alcoholhydrocarbon derivativeacryloyl-groupketeneenone |
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