| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 06:29:06 UTC |
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| Update Date | 2025-03-24 17:50:26 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00984522 |
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| Frequency | 1.4 |
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| Structure | |
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| Chemical Formula | C7H8O3 |
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| Molecular Mass | 140.0473 |
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| SMILES | CC=CC(=O)CC(O)=C=O |
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| InChI Key | QWNYEXWFHJCLRH-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 | b'-hydroxy-alpha,beta-unsaturated ketones |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acryloyl compoundsbeta-hydroxy ketonesenoneshydrocarbon derivativesorganic oxidesynolates |
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| Substituents | beta-hydroxy ketonealiphatic acyclic compoundb'-hydroxy-alpha,beta-unsaturated-ketoneketoneorganic oxideynolatehydrocarbon derivativeacryloyl-groupenone |
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