Metabolomics Structure Database
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MW REGNO: | 1613 |
Common Name: | 16-oxo-heptadecanoic acid |
Systematic Name: | 16-oxo-heptadecanoic acid |
RefMet Name: | 16-Oxoheptadecanoic acid |
Synonyms: | [PubChem Synonyms] |
Exact Mass: | |
Formula: | C17H32O3 |
InChIKey: | APFVJHNDSBIJTB-UHFFFAOYSA-N |
LIPID MAPS Category: | Fatty Acyls [FA] |
LIPID MAPS mainclass: | Fatty Acids and Conjugates [FA01] |
LIPID MAPS subclass: | Oxo fatty acids [FA0106] |
SMILES: | CC(=O)CCCCCCCCCCCCCCC(=O)O |
Studies: | Available studies (via RefMet name) |
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References
LIPID MAPS classification: "Update of the LIPID MAPS comprehensive classification system for lipids", Fahy E, Subramaniam S, Murphy RC, Nishijima M, Raetz CR, Shimizu T, Spener F, van Meer G, Wakelam MJ, and Dennis EA, J. Lipid Res. (2009) 50: S9-S14. DOI: 10.1194/jlr.R800095-JLR200 ClassyFire classification: "ClassyFire: automated chemical classification with a comprehensive, computable taxonomy", Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS, J. Cheminformatics (2016) 8:61. DOI: 10.1186/s13321-016-0174-y