| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:21:36 UTC |
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| Update Date | 2025-03-21 18:37:09 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00114238 |
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| Frequency | 23.1 |
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| Structure | |
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| Chemical Formula | C6H10O2 |
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| Molecular Mass | 114.0681 |
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| SMILES | COC(C)=CC(C)=O |
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| InChI Key | CDWAKLKSWYVUSL-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 oxidesvinylogous esters |
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| Substituents | ketonealiphatic acyclic compoundcarbonyl grouporganic oxidevinylogous esterhydrocarbon derivativeacryloyl-groupalpha,beta-unsaturated ketoneenone |
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