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CHEBI:165772 - alpha-Artemisic acid

ChEBI IDCHEBI:165772
ChEBI Namealpha-Artemisic acid
Stars
Last Modified24 February 2022
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H32O3
Net Charge0
Average Mass296.451
Monoisotopic Mass296.23514
SMILESCCCCCC(O)/C=C/C=C/CCCCCCCC(=O)O
InChIInChI=1S/C18H32O3/c1-2-3-11-14-17(19)15-12-9-7-5-4-6-8-10-13-16-18(20)21/h7,9,12,15,17,19H,2-6,8,10-11,13-14,16H2,1H3,(H,20,21)/b9-7+,15-12+
InChIKeyHNICUWMFWZBIFP-KDFHGORWSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
alpha-Artemisic acid (CHEBI:165772) is a octadecadienoic acid (CHEBI:25627)
IUPAC Name 
(9E,11E)-13-hydroxyoctadeca-9,11-dienoic acid
Manual XrefsDatabases
4446075ChemSpider
LMFA01050125LIPID MAPS
Registry NumbersSources
CAS:5204-88-6ChemIDplus