EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:203970 - Koshikalide

ChEBI IDCHEBI:203970
ChEBI NameKoshikalide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H26O4
Net Charge0
Average Mass294.391
Monoisotopic Mass294.18311
SMILESCO[C@@H]1C=CCC/C(C)=C\C/C(C)=C\C(=O)O[C@@H](CO)C1
InChIInChI=1S/C17H26O4/c1-13-6-4-5-7-15(20-3)11-16(12-18)21-17(19)10-14(2)9-8-13/h5,7-8,10,15-16,18H,4,6,9,11-12H2,1-3H3/b7-5?,13-8-,14-10-/t15-,16-/m1/s1
InChIKeyQFQKOFIKPPGGPV-NKXUIWCXSA-N
Species of MetaboliteComponentSourceComments
Lyngbya (ncbitaxon:28073) - DOI (10.1016/j.tetlet.2009.12.041)
ChEBI Ontology
Outgoing Relation(s)
Koshikalide (CHEBI:203970) is a macrolide (CHEBI:25106)
IUPAC Name 
(3Z,6Z,12S,14R)-14-(hydroxymethyl)-12-methoxy-4,7-dimethyl-1-oxacyclotetradeca-3,6,10-trien-2-one