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 eMolecules:2899199, ZINC000002169935
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
Last Modified
19 September 2018