EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:228062 - Rigidoporone B

ChEBI IDCHEBI:228062
ChEBI NameRigidoporone B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H24O4
Net Charge0
Average Mass268.353
Monoisotopic Mass268.16746
SMILESCC1(C)O[C@@H]2[C@H]3[C@H]1CC[C@](C)(O)[C@@H]3CC(=O)[C@]2(C)O
InChIInChI=1S/C15H24O4/c1-13(2)8-5-6-14(3,17)9-7-10(16)15(4,18)12(19-13)11(8)9/h8-9,11-12,17-18H,5-7H2,1-4H3/t8-,9-,11+,12-,14+,15+/m1/s1
InChIKeyFQJNBMDLOIHXER-PFJQPICRSA-N
Species of MetaboliteComponentSourceComments
Rigidoporus microporus (ncbitaxon:219653) - DOI (10.1016/j.phytol.2019.05.016)
ChEBI Ontology
Outgoing Relation(s)
Rigidoporone B (CHEBI:228062) is a secondary α-hydroxy ketone (CHEBI:2468)
IUPAC Name 
(1R,4R,7S,8R,11R,12R)-7,11-dihydroxy-3,3,7,11-tetramethyl-2-oxatricyclo[6.3.1.04,12]dodecan-10-one