CHEBI:32411 - octadeca-10,12-diynoic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name octadeca-10,12-diynoic acid
ChEBI ID CHEBI:32411
Definition An octadecadiynoic acid having its triple bonds at positions 10 and 12.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
more structures >>
Formula C18H28O2
Net Charge 0
Average Mass 276.414
Monoisotopic Mass 276.20893
InChI InChI=1S/C18H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-5,10-17H2,1H3,(H,19,20)
InChIKey WNNYSRHBDYRXCH-UHFFFAOYSA-N
SMILES C(CCCCCCCCC#CC#CCCCCC)(=O)O
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 octadeca-10,12-diynoic acid (CHEBI:32411) is a octadecadiynoic acid (CHEBI:61234)
IUPAC Name
octadeca-10,12-diynoic acid
Synonyms Sources
10,12-octadecadiynoic acid NIST Chemistry WebBook
10a12a-18:2 ChEBI
Octadeca-10,12-diinsäure ChEBI
Registry Numbers Types Sources
1786681 Reaxys Registry Number Reaxys
7333-25-7 CAS Registry Number NIST Chemistry WebBook
Citations Waiting for Citations Types Sources
1182928 PubMed citation Europe PMC
23594344 PubMed citation Europe PMC
30023552 PubMed citation Europe PMC
Last Modified
19 September 2018