| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:29:51 UTC |
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| Update Date | 2025-03-21 18:41:20 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00133733 |
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| Frequency | 18.8 |
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| Structure | |
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| Chemical Formula | C9H16O2 |
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| Molecular Mass | 156.115 |
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| SMILES | CCCCC(O)C=CC(C)=O |
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| InChI Key | OFSWUYZVGCXVCE-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 | acryloyl compounds |
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| Direct Parent | acryloyl compounds |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | enoneshydrocarbon derivativesketonesorganic oxidessecondary alcohols |
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| Substituents | alcoholaliphatic acyclic compoundcarbonyl groupalpha,beta-unsaturated ketoneketoneorganic oxidesecondary alcoholhydrocarbon derivativeacryloyl-groupenone |
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