Record Information  Version 1.0 Status Detected and Quantified Creation Date 2022-06-17 19:33:46 UTC Update Date 2022-08-12 20:09:04 UTC MiMeDB ID MMDBc0054752 Metabolite Identification  Common Name (11R)-hydroperoxy-(9Z,12Z)-octadecadienoic acid Description Based on a literature review very few articles have been published on (11R)-11-hydroperoxylinoleate. Structure Synonyms Value Source (11R)-11-Hydroperoxylinoleate anion ChEBI (11R)-Hydroperoxy-(9Z,12Z)-octadecadienoate ChEBI (9Z,11R,12Z)-11-Hydroperoxyoctadecadienoate ChEBI (11R)-11-Hydroperoxylinoleic acid anion Generator (11R)-Hydroperoxy-(9Z,12Z)-octadecadienoic acid Generator (9Z,11R,12Z)-11-Hydroperoxyoctadecadienoic acid Generator (11R)-11-Hydroperoxylinoleic acid Generator 
Chemical Formula C18 H31 O4  Average Molecular Weight 311.443 Monoisotopic Molecular Weight 311.222783058 IUPAC Name Not Available Traditional Name Not Available CAS Registry Number Not Available SMILES Not Available InChI Identifier InChI=1S/C18H32O4/c1-2-3-4-8-11-14-17(22-21)15-12-9-6-5-7-10-13-16-18(19)20/h11-12,14-15,17,21H,2-10,13,16H2,1H3,(H,19,20)/p-1/b14-11-,15-12-/t17-/m1/s1
InChI Key PLWDMWAXENHPLY-LILDEJAOSA-M Chemical Taxonomy  Functional Ontology  Not Available Physical Properties  State Expected Solid Predicted Properties Not Available Spectra  Not Available Biological Properties  Cellular Locations Not Available Biospecimen Locations Not Available Tissue Locations Not Available Associated OMIM IDs 114500     (Colorectal cancer)610247     (Eosinophilic esophagitis)Human Proteins and Enzymes  Proteins Human Pathways  Pathways Metabolic Reactions  Reaction ID Precursor Product Enzyme Reaction Type Data Source Reference 
Health Effects and Bioactivity  Health Outcome/Bioactivity Metabolite Response/Effect Related Health Condition Evidence Type Measured in Matrix Data Source Reference 
Microbial Sources  Kingdom Phylum Total species Hosts and Body Sites Microbial Links Fungi Ascomycota 1 
Exposure Sources  Source Type Source Sub-type Species Data Source Reference Details 
Host Biospecimen and Location  Host and Biospecimen Status Mean    Std    Min    Max    Units Age Sex Health Condition Data Source Reference 
External Links  HMDB ID Not Available DrugBank ID Not Available Phenol Explorer Compound ID Not Available FooDB ID Not Available KNApSAcK ID Not Available Chemspider ID 58827349    KEGG Compound ID Not Available BioCyc ID Not Available BiGG ID Not Available Wikipedia Link Not Available METLIN ID Not Available PubChem Compound 124079405    PDB ID Not Available ChEBI ID 134248    Food Biomarker Ontology Not Available References  Synthesis Reference Not Available General References Bansal P, Morgat A, Axelsen KB, Muthukrishnan V, Coudert E, Aimo L, Hyka-Nouspikel N, Gasteiger E, Kerhornou A, Neto TB, Pozzato M, Blatter MC, Ignatchenko A, Redaschi N, Bridge A: Rhea, the reaction knowledgebase in 2022. Nucleic Acids Res. 2022 Jan 7;50(D1):D693-D700. doi: 10.1093/nar/gkab1016. [PubMed:34755880    ]