CHEBI:184131 - 12,15-Epoxy-13,14-dimethyleicosa-10,12,14-trienoic acid

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ChEBI Name 12,15-Epoxy-13,14-dimethyleicosa-10,12,14-trienoic acid
ChEBI ID CHEBI:184131
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C22H36O3
Net Charge 0
Average Mass 348.527
Monoisotopic Mass 348.26645
InChI InChI=1S/C22H36O3/c1-4-5-12-15-20-18(2)19(3)21(25-20)16-13-10-8-6-7-9-11-14-17-22(23)24/h13,16H,4-12,14-15,17H2,1-3H3,(H,23,24)/b16-13+
InChIKey XCBKJOCQMTZFQG-DTQAZKPQSA-N
SMILES O1C(CCCCC)=C(C(=C1\C=C\CCCCCCCCC(O)=O)C)C
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in serum (BTO:0001239). See: MetaboLights Study
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 12,15-Epoxy-13,14-dimethyleicosa-10,12,14-trienoic acid (CHEBI:184131) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name
(E)-11-(3,4-dimethyl-5-pentyluran-2-yl)undec-10-enoic acid
Manual Xrefs Databases
74849729 ChemSpider
HMDB0112069 HMDB
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