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CHEBI:168086 - Acorusnol

ChEBI IDCHEBI:168086
ChEBI NameAcorusnol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H24O2
Net Charge0
Average Mass236.355
Monoisotopic Mass236.17763
SMILESCC1=C2C(=O)[C@H](C(C)C)CC[C@@]2(C)[C@H](O)CC1
InChIInChI=1S/C15H24O2/c1-9(2)11-7-8-15(4)12(16)6-5-10(3)13(15)14(11)17/h9,11-12,16H,5-8H2,1-4H3/t11-,12+,15-/m0/s1
InChIKeySZNXJUGSSOHWJM-ZOWXZIJZSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
Acorusnol (CHEBI:168086) is a eudesmane sesquiterpenoid (CHEBI:62508)
IUPAC Name 
(2S,4aR,5R)-5-hydroxy-4a,8-dimethyl-2-propan-2-yl-2,3,4,5,6,7-hexahydronaphthalen-1-one