EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:3854 - Confertiflorin

ChEBI IDCHEBI:3854
ChEBI NameConfertiflorin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC17H22O5
Net Charge0
Average Mass306.358
Monoisotopic Mass306.14672
SMILES[H][C@@]12OC(=O)C(=C)[C@]1([H])[C@@H](OC(C)=O)C[C@H](C)[C@]1([H])CCC(=O)[C@@]21C
InChIInChI=1S/C17H22O5/c1-8-7-12(21-10(3)18)14-9(2)16(20)22-15(14)17(4)11(8)5-6-13(17)19/h8,11-12,14-15H,2,5-7H2,1,3-4H3/t8-,11-,12-,14+,15+,17-/m0/s1
InChIKeyVWBKXLDATRBPOE-VICSMPQUSA-N
ChEBI Ontology
Outgoing Relation(s)
Confertiflorin (CHEBI:3854) is a sesquiterpene lactone (CHEBI:37667)
Synonyms  Source
ConfertiflorinKEGG COMPOUND
(+)-ConfertiflorinKEGG COMPOUND
Manual XrefsDatabases
C09374KEGG COMPOUND
C00003235KNApSAcK
Registry NumbersSources
CAS:17066-70-5KEGG COMPOUND