CHEBI:178363 - 2-methoxy-12-methyloctadec-17-en-5-ynoyl anhydride

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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 2-methoxy-12-methyloctadec-17-en-5-ynoyl anhydride
ChEBI ID CHEBI:178363
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C40H66O5
Net Charge 0
Average Mass 626.963
Monoisotopic Mass 626.49103
InChI InChI=1S/C40H66O5/c1-7-9-11-23-29-35(3)31-25-19-15-13-17-21-27-33-37(43-5)39(41)45-40(42)38(44-6)34-28-22-18-14-16-20-26-32-36(4)30-24-12-10-8-2/h7-8,35-38H,1-2,9-16,19-20,23-34H2,3-6H3
InChIKey VOGBKCAANIAXCI-UHFFFAOYSA-N
SMILES O(C(CCC#CCCCCCC(CCCCC=C)C)C(OC(=O)C(OC)CCC#CCCCCCC(CCCCC=C)C)=O)C
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 2-methoxy-12-methyloctadec-17-en-5-ynoyl anhydride (CHEBI:178363) is a dicarboxylic acid (CHEBI:35692)
IUPAC Name
(2-methoxy-12-methyloctadec-17-en-5-ynoyl) 2-methoxy-12-methyloctadec-17-en-5-ynoate
Manual Xrefs Databases
9105434 ChemSpider
LMFA00000001 LIPID MAPS
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