EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:180530 - 10,11-Epidioxycalamene

ChEBI IDCHEBI:180530
ChEBI Name10,11-Epidioxycalamene
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H20O2
Net Charge0
Average Mass232.323
Monoisotopic Mass232.14633
SMILESCc1ccc2c(c1)C1CCC2(C)OOC1(C)C
InChIInChI=1S/C15H20O2/c1-10-5-6-13-11(9-10)12-7-8-15(13,4)17-16-14(12,2)3/h5-6,9,12H,7-8H2,1-4H3
InChIKeyALXPNLYWXCZUCG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS3233)
ChEBI Ontology
Outgoing Relation(s)
10,11-Epidioxycalamene (CHEBI:180530) is a tetralins (CHEBI:36786)
IUPAC Name 
4,8,11,11-tetramethyl-9,10-dioxatricyclo[6.3.2.02,7]trideca-2(7),3,5-triene
Manual XrefsDatabases
8574497ChemSpider
HMDB0041062HMDB