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CHEBI:198812 - Trichocladinol E

ChEBI IDCHEBI:198812
ChEBI NameTrichocladinol E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H14O5
Net Charge0
Average Mass226.228
Monoisotopic Mass226.08412
SMILESC[C@@H]1C=C[C@H](O)[C@H]2O[C@@]3(C)OC(=O)[C@@]12[C@@H]3O
InChIInChI=1S/C11H14O5/c1-5-3-4-6(12)7-11(5)8(13)10(2,15-7)16-9(11)14/h3-8,12-13H,1-2H3/t5-,6+,7-,8-,10+,11+/m1/s1
InChIKeyZMFMHHDPSXFPHY-IKKULVOHSA-N
Species of MetaboliteComponentSourceComments
Pleotrichocladium opacum (ncbitaxon:2016671) - PubMed (24354429)
ChEBI Ontology
Outgoing Relation(s)
Trichocladinol E (CHEBI:198812) is a ketal (CHEBI:59777)
IUPAC Name 
(1R,2R,5S,6S,8S,11S)-5,11-dihydroxy-2,8-dimethyl-7,9-dioxatricyclo[6.2.1.01,6]undec-3-en-10-one
Manual XrefsDatabases
31126525ChemSpider