EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:206888 - Skeletocutin A

ChEBI IDCHEBI:206888
ChEBI NameSkeletocutin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H34O8
Net Charge0
Average Mass462.539
Monoisotopic Mass462.22537
SMILESCC1=C(CCCCCCCCCCCCCCC2=C(C(=O)O)CC(=O)OC2=O)C(=O)OC1=O
InChIInChI=1S/C25H34O8/c1-17-18(24(30)33-23(17)29)14-12-10-8-6-4-2-3-5-7-9-11-13-15-19-20(22(27)28)16-21(26)32-25(19)31/h2-16H2,1H3,(H,27,28)
InChIKeyGYKFRMWNWAEOIH-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Skeletocutisspecies (ncbitaxon:2028179) - PubMed (31310114)
ChEBI Ontology
Outgoing Relation(s)
Skeletocutin A (CHEBI:206888) has functional parent hexacarboxylic acid (CHEBI:59359)
Skeletocutin A (CHEBI:206888) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
5-[14-(4-methyl-2,5-dioxouran-3-yl)tetradecyl]-2,6-dioxo-3H-pyran-4-carboxylic acid