EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:146782 - Smaditerpenic acid E

ChEBI IDCHEBI:146782
ChEBI NameSmaditerpenic acid E
Stars
Submittermwilliams
DownloadsMolfile
FormulaC22H34O5
Net Charge0
Average Mass378.509
Monoisotopic Mass378.24062
SMILESCC(=O)OC/C(=C\CC/C(C)=C\CO)CC/C=C(/CCC=C(C)C)C(=O)O
InChIInChI=1S/C22H34O5/c1-17(2)8-5-12-21(22(25)26)13-7-11-20(16-27-19(4)24)10-6-9-18(3)14-15-23/h8,10,13-14,23H,5-7,9,11-12,15-16H2,1-4H3,(H,25,26)/b18-14-,20-10-,21-13-
InChIKeyCHFKBSVLWUYDDC-WAZPLBEQSA-N
Species of MetaboliteComponentSourceComments
Smallanthus sonchifolius (ncbitaxon:185202) leaf lamina (BTO:0000719) PubMed (21213966)
ChEBI Ontology
Outgoing Relation(s)
Smaditerpenic acid E (CHEBI:146782) is a diterpenoid (CHEBI:23849)