EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:199268 - Radianspene E

ChEBI IDCHEBI:199268
ChEBI NameRadianspene E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H34O5
Net Charge0
Average Mass378.509
Monoisotopic Mass378.24062
SMILESCC(=O)O[C@@H]1[C@H](O)[C@H](C(C)C)[C@@]2(C)CC[C@]3(C)CC[C@H](O)C4=C3[C@H](OC4)[C@@H]12
InChIInChI=1S/C22H34O5/c1-11(2)15-18(25)20(27-12(3)23)17-19-16-13(10-26-19)14(24)6-7-21(16,4)8-9-22(15,17)5/h11,14-15,17-20,24-25H,6-10H2,1-5H3/t14-,15-,17-,18+,19-,20-,21-,22+/m0/s1
InChIKeyRQLGNNVVLDWWNK-NUAQGFLESA-N
Species of MetaboliteComponentSourceComments
Coprinus (ncbitaxon:5345) - PubMed (22521133)
ChEBI Ontology
Outgoing Relation(s)
Radianspene E (CHEBI:199268) is a dihydrofuran (CHEBI:51659)
IUPAC Name 
[(1R,2S,3S,4R,5R,6R,9R,12S)-4,12-dihydroxy-6,9-dimethyl-5-propan-2-yl-15-oxatetracyclo[7.6.1.02,6.013,16]hexadec-13(16)-en-3-yl] acetate
Manual XrefsDatabases
32742603ChemSpider