| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:06:26 UTC |
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| Update Date | 2025-03-25 00:56:06 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02216188 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H12O4 |
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| Molecular Mass | 184.0736 |
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| SMILES | CCCC=C(O)CC(=O)C(O)=C=O |
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| InChI Key | LNYCMEGCBBZWJB-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 | beta-hydroxy ketones |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acryloyl compoundsalpha-hydroxy ketonesenoneshydrocarbon derivativesorganic oxidesynolates |
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| Substituents | beta-hydroxy ketonealiphatic acyclic compoundalpha-hydroxy ketoneorganic oxideynolatehydrocarbon derivativeacryloyl-groupenone |
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