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CHEBI:174299 - Heliannuol D

ChEBI IDCHEBI:174299
ChEBI NameHeliannuol D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O3
Net Charge0
Average Mass250.338
Monoisotopic Mass250.15689
SMILESCc1cc2c(cc1O)C(C)CCC(C(C)(C)O)O2
InChIInChI=1S/C15H22O3/c1-9-5-6-14(15(3,4)17)18-13-7-10(2)12(16)8-11(9)13/h7-9,14,16-17H,5-6H2,1-4H3
InChIKeyBIIJJHXLFCDTIZ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Heliannuol D (CHEBI:174299) is a oxacycle (CHEBI:38104)
IUPAC Name 
2-(2-hydroxypropan-2-yl)-5,8-dimethyl-2,3,4,5-tetrahydro-1-benzoxepin-7-ol
Manual XrefsDatabases
HMDB0035137HMDB
9600106ChemSpider