| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 04:02:07 UTC |
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| Update Date | 2025-03-21 23:05:35 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00632238 |
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| Frequency | 2.5 |
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| Structure | |
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| Chemical Formula | C6H12O3 |
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| Molecular Mass | 132.0786 |
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| SMILES | CCCC(O)(O)CC=O |
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| InChI Key | ZWVRWHFKFNJRFY-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 | medium-chain aldehydes |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha-hydrogen aldehydesbeta-hydroxy aldehydescarbonyl hydrateshydrocarbon derivativesorganic oxides |
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| Substituents | aliphatic acyclic compoundbeta-hydroxy aldehydeorganic oxidecarbonyl hydratealpha-hydrogen aldehydehydrocarbon derivativemedium-chain aldehyde |
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