EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:224094 - Rhodocorane L

ChEBI IDCHEBI:224094
ChEBI NameRhodocorane L
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H20O4
Net Charge0
Average Mass264.321
Monoisotopic Mass264.13616
SMILESCC1=C(O)C(=O)[C@]23C(=O)[C@H]1[C@H](O)[C@@H](C)[C@H]2CC[C@H]3C
InChIInChI=1S/C15H20O4/c1-6-4-5-9-7(2)11(16)10-8(3)12(17)14(19)15(6,9)13(10)18/h6-7,9-11,16-17H,4-5H2,1-3H3/t6-,7+,9-,10-,11-,15+/m1/s1
InChIKeyPSRWXKPUAGZVKZ-CNQZAIAMSA-N
Species of MetaboliteComponentSourceComments
Rhodotus palmatus (ncbitaxon:71920) - PubMed (31820970)
ChEBI Ontology
Outgoing Relation(s)
Rhodocorane L (CHEBI:224094) is a cyclohexenones (CHEBI:48953)
IUPAC Name 
(1S,2R,5R,6S,7R,8R)-7,10-dihydroxy-2,6,9-trimethyltricyclo[6.3.1.01,5]dodec-9-ene-11,12-dione