Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:38:45 UTC |
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Update Date | 2025-03-21 17:58:10 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00012611 |
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Frequency | 359.1 |
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Structure | |
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Chemical Formula | C4H6O2 |
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Molecular Mass | 86.0368 |
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SMILES | C=CCC(=O)O |
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InChI Key | PVEOYINWKBTPIZ-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 | straight chain fatty acids |
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Geometric Descriptor | aliphatic acyclic compounds |
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Alternative Parents | carbonyl compoundscarboxylic acidsfatty acylshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
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Substituents | aliphatic acyclic compoundcarbonyl grouporganic oxidemonocarboxylic acid or derivativesstraight chain fatty acidcarboxylic acidorganic oxygen compoundhydrocarbon derivativecarboxylic acid derivativeorganooxygen compound |
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