Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 08:23:56 UTC |
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Update Date | 2025-03-25 00:16:43 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID01261924 |
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Frequency | 1.1 |
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Structure | |
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Chemical Formula | C7H12O2 |
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Molecular Mass | 128.0837 |
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SMILES | CC(=O)C=COC(C)C |
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InChI Key | YWUDSTZCDSLKEQ-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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