Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:49:53 UTC |
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Update Date | 2025-03-25 00:50:02 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02178289 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C7H4F10O3 |
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Molecular Mass | 326.0001 |
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SMILES | COC(=O)C(O)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F |
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InChI Key | AZHXOHPYFFHRLM-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 acid esters |
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Direct Parent | fatty acid esters |
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Geometric Descriptor | aliphatic acyclic compounds |
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Alternative Parents | alcohols and polyolsalkyl fluoridesalpha-halocarboxylic acid derivativescarbonyl compoundsfluorohydrinshydrocarbon derivativesmethyl estersmonocarboxylic acids and derivativesorganic oxidesorganofluorides |
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Substituents | alcoholalpha-halocarboxylic acid or derivativesaliphatic acyclic compoundcarbonyl grouphalohydrinalkyl fluorideorganofluoridefluorohydrincarboxylic acid derivativeorganohalogen compoundalpha-halocarboxylic acid derivativefatty acid esterorganic oxidemonocarboxylic acid or derivativesmethyl esterorganic oxygen compoundcarboxylic acid esteralkyl halidehydrocarbon derivativeorganooxygen compound |
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