| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:05:00 UTC |
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| Update Date | 2025-03-25 00:55:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02212963 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H22O3 |
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| Molecular Mass | 226.1569 |
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| SMILES | CCCCCCCC=CC(=O)CCC(=O)O |
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| InChI Key | DJCGUNSHZXHCDX-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | fatty acyls |
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| Subclass | fatty acids and conjugates |
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| Direct Parent | long-chain fatty acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acryloyl compoundscarboxylic acidsenonesfatty acylsgamma-keto acids and derivativeshydrocarbon derivativesketo fatty acidsketonesmonocarboxylic acids and derivativesorganic oxides |
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| Substituents | aliphatic acyclic compoundcarbonyl grouplong-chain fatty acidcarboxylic acidketo fatty acidalpha,beta-unsaturated ketonecarboxylic acid derivativegamma-keto acidketoneorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundketo acidhydrocarbon derivativeacryloyl-grouporganooxygen compoundenone |
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