EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:223662 - Phellinuin J

ChEBI IDCHEBI:223662
ChEBI NamePhellinuin J
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O3
Net Charge0
Average Mass250.338
Monoisotopic Mass250.15689
SMILESC[C@H]1C[C@@H]2C[C@@]3(C)C[C@]2(O)[C@](C)(OC3=O)C12CC2
InChIInChI=1S/C15H22O3/c1-9-6-10-7-12(2)8-15(10,17)13(3,18-11(12)16)14(9)4-5-14/h9-10,17H,4-8H2,1-3H3/t9-,10+,12-,13+,15+/m0/s1
InChIKeySJQJRTVZDXKENK-DPXGPQMFSA-N
Species of MetaboliteComponentSourceComments
Phellinus tuberculosus (ncbitaxon:123902) - PubMed (26000880)
ChEBI Ontology
Outgoing Relation(s)
Phellinuin J (CHEBI:223662) is a diterpenoid (CHEBI:23849)
IUPAC Name 
(1S,4R,6S,8R,9R)-9-hydroxy-1,4,6-trimethylspiro[3-oxatricyclo[6.2.1.04,9]undecane-5,1'-cyclopropane]-2-one