| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 05:36:23 UTC |
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| Update Date | 2025-03-24 14:30:08 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00858182 |
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| Frequency | 1.7 |
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| Structure | |
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| Chemical Formula | C7H10O3 |
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| Molecular Mass | 142.063 |
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| SMILES | CCC=C(O)C(=O)C(C)=O |
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| InChI Key | DZMLSDNPQBILDB-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 | alpha-diketones |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acryloyl compoundsalpha-branched alpha,beta-unsaturated ketonesalpha-hydroxy ketonesbeta-hydroxy ketonesenoneshydrocarbon derivativesorganic oxides |
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| Substituents | alpha-branched alpha,beta-unsaturated-ketonebeta-hydroxy ketonealiphatic acyclic compoundalpha,beta-unsaturated ketonealpha-hydroxy ketonealpha-diketoneorganic oxidehydrocarbon derivativeacryloyl-groupenone |
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