EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:216800 - Radianspene F

ChEBI IDCHEBI:216800
ChEBI NameRadianspene F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H36O4
Net Charge0
Average Mass376.537
Monoisotopic Mass376.26136
SMILESCC(C)[C@H]1[C@H]2OC(C)(C)O[C@H]2[C@@H]2[C@H]3OCC4=C3[C@@](C)(CC[C@@H]4O)CC[C@@]21C
InChIInChI=1S/C23H36O4/c1-12(2)15-19-20(27-21(3,4)26-19)17-18-16-13(11-25-18)14(24)7-8-22(16,5)9-10-23(15,17)6/h12,14-15,17-20,24H,7-11H2,1-6H3/t14-,15-,17-,18-,19+,20-,22-,23+/m0/s1
InChIKeyZAFBDBZIQHIUHT-GFEDBVBQSA-N
Species of MetaboliteComponentSourceComments
Coprinus (ncbitaxon:5345) - PubMed (22521133)
ChEBI Ontology
Outgoing Relation(s)
Radianspene F (CHEBI:216800) is a ketal (CHEBI:59777)
IUPAC Name 
(1R,2S,3S,7R,8R,9R,12R,15S)-5,5,9,12-tetramethyl-8-propan-2-yl-4,6,18-trioxapentacyclo[10.6.1.02,9.03,7.016,19]nonadec-16(19)-en-15-ol
Manual XrefsDatabases
78442320ChemSpider