| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 02:03:58 UTC |
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| Update Date | 2025-03-21 20:46:28 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00352379 |
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| Frequency | 5.4 |
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| Structure | |
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| Chemical Formula | C5H8O3 |
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| Molecular Mass | 116.0473 |
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| SMILES | CC(CO)C(=O)C=O |
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| InChI Key | ROKGRLJNHSUEOC-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 | alpha ketoaldehydeshydrocarbon derivativesorganic oxidesprimary alcoholsshort-chain aldehydes |
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| Substituents | alcoholbeta-hydroxy ketonealiphatic acyclic compoundshort-chain aldehydealdehydeorganic oxidehydrocarbon derivativeprimary alcoholalpha-ketoaldehyde |
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