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CHEBI:80747 - Homobaldrinal

ChEBI IDCHEBI:80747
ChEBI NameHomobaldrinal
Stars
Last Modified27 July 2018
DownloadsMolfile
FormulaC15H16O4
Net Charge0
Average Mass260.289
Monoisotopic Mass260.10486
SMILESCC(C)CC(=O)OCc1cocc2c(C=O)ccc1-2
InChIInChI=1S/C15H16O4/c1-10(2)5-15(17)19-8-12-7-18-9-14-11(6-16)3-4-13(12)14/h3-4,6-7,9-10H,5,8H2,1-2H3
InChIKeyLTVSLKWNAZKBEX-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Homobaldrinal (CHEBI:80747) is a fatty acid ester (CHEBI:35748)
Synonyms  Source
(7-formylcyclopenta[c]pyran-4-yl)methyl 3-methylbutanoateChEBI
Butanoic acid, 3-methyl-, (7-formylcyclopenta(c)pyran-4-yl)methyl esterNIST Chemistry WebBook
Manual XrefsDatabases
C16812KEGG COMPOUND
Registry NumbersSources
Reaxys:6212898Reaxys
CAS:67910-07-0KEGG COMPOUND
CAS:67910-07-0ChemIDplus
CAS:67910-07-0NIST Chemistry WebBook