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CHEBI:217464 - 16,18-dibromo-(15E,17Z)-octadeca-15,17-diene-5,7-diynoic acid methyl ester

ChEBI IDCHEBI:217464
ChEBI Name16,18-dibromo-(15E,17Z)-octadeca-15,17-diene-5,7-diynoic acid methyl ester
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H22Br2O2
Net Charge0
Average Mass430.180
Monoisotopic Mass427.99865
SMILESO=C(O)CCCC#CC#CCCCCCC/C=C(Br)\C=C/Br
InChIInChI=1S/C18H22Br2O2/c19-16-15-17(20)13-11-9-7-5-3-1-2-4-6-8-10-12-14-18(21)22/h13,15-16H,1,3,5,7,9-12,14H2,(H,21,22)/b16-15-,17-13+
InChIKeyRLRJXJRYJUCIAH-FGNGAWNESA-N
Species of MetaboliteComponentSourceComments
Leptogium saturninum (ncbitaxon:243206) - DOI (10.1016/s0031-9422(99)00034-5)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
16,18-dibromo-(15E,17Z)-octadeca-15,17-diene-5,7-diynoic acid methyl ester (CHEBI:217464) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
(15E,17Z)-16,18-dibromooctadeca-15,17-dien-5,7-diynoic acid
Manual XrefsDatabases
78435017ChemSpider