| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 11:44:17 UTC |
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| Update Date | 2025-03-24 21:19:23 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01740600 |
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| Frequency | 0.7 |
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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 | O=C(C=CCO)CO |
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| InChI Key | HEOCJLGAHGCVFQ-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-hydroxy ketones |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acryloyl compoundsenoneshydrocarbon derivativesorganic oxidesprimary alcohols |
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| Substituents | alcoholaliphatic acyclic compoundalpha,beta-unsaturated ketonealpha-hydroxy ketoneorganic oxidehydrocarbon derivativeacryloyl-groupprimary alcoholenone |
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