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CHEBI:4366 - dehydromatricaria ester

ChEBI IDCHEBI:4366
ChEBI Namedehydromatricaria ester
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC11H8O2
Net Charge0
Average Mass172.183
Monoisotopic Mass172.05243
SMILESCC#CC#CC#C/C=C/C(=O)OC
InChIInChI=1S/C11H8O2/c1-3-4-5-6-7-8-9-10-11(12)13-2/h9-10H,1-2H3/b10-9+
InChIKeyLBAVIXQTLKRIGP-MDZDMXLPSA-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)
dehydromatricaria ester (CHEBI:4366) is a methyl dec-2-ene-4,6,8-triynoate (CHEBI:35914)
Synonyms  Source
Dehydromatricaria esterKEGG COMPOUND
(E)-2-Decene-4,6,8-triynoic acid methyl esterKEGG COMPOUND
Manual XrefsDatabases
C08446KEGG COMPOUND
C00001280KNApSAcK
HMDB0033765HMDB
Registry NumbersSources
CAS:692-94-4KEGG COMPOUND