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CHEBI:198953 - Hebelophyllene E

ChEBI IDCHEBI:198953
ChEBI NameHebelophyllene E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H24O3
Net Charge0
Average Mass252.354
Monoisotopic Mass252.17254
SMILESC=CC(C)(O)[C@@H]1C[C@H]2[C@H](CC2(C)C)[C@@H](C)C(=O)O1
InChIInChI=1S/C15H24O3/c1-6-15(5,17)12-7-11-10(8-14(11,3)4)9(2)13(16)18-12/h6,9-12,17H,1,7-8H2,2-5H3/t9-,10-,11+,12+,15?/m1/s1
InChIKeyDGHMLXSJSLBSKG-QASSWSFNSA-N
Species of MetaboliteComponentSourceComments
Hebeloma longicaudum (ncbitaxon:165406) - PubMed (10096864)
ChEBI Ontology
Outgoing Relation(s)
Hebelophyllene E (CHEBI:198953) is a lactone (CHEBI:25000)
IUPAC Name 
(1S,2R,5S,7S)-5-(2-hydroxybut-3-en-2-yl)-2,8,8-trimethyl-4-oxabicyclo[5.2.0]nonan-3-one
Manual XrefsDatabases
8666442ChemSpider