CHEBI:193262 - Agonandric acid

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Agonandric acid
ChEBI ID CHEBI:193262
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C18H30O3
Net Charge 0
Average Mass 294.435
Monoisotopic Mass 294.21949
InChI InChI=1S/C18H30O3/c1-2-3-4-5-6-7-8-11-14-17(19)15-12-9-10-13-16-18(20)21/h7-8,17,19H,2-6,9-10,12-13,15-16H2,1H3,(H,20,21)/b8-7+
InChIKey OTAWOAZBNLPFQR-BQYQJAHWSA-N
SMILES OC(CCCCCCC(O)=O)C#C\C=C\CCCCCC
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in feces (BTO:0000440). 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 )
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ChEBI Ontology
Outgoing Agonandric acid (CHEBI:193262) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name
(E)-8-hydroxyoctadec-11-en-9-ynoic acid
Manual Xrefs Databases
11476136 ChemSpider
LMFA01050307 LIPID MAPS
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