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CHEBI:10360 - (R)-(+)-citronellol

ChEBI IDCHEBI:10360
ChEBI Name(R)-(+)-citronellol
Stars
ASCII Name(R)-(+)-citronellol
DefinitionA citronellol that is oct-6-ene substituted by a hydroxy group at position 1 and methyl groups at positions 3 and 7 (the 3R-enantiomer).
Last Modified23 October 2015
DownloadsMolfile
FormulaC10H20O
Net Charge0
Average Mass156.269
Monoisotopic Mass156.15142
SMILESCC(C)=CCC[C@@H](C)CCO
InChIInChI=1S/C10H20O/c1-9(2)5-4-6-10(3)7-8-11/h5,10-11H,4,6-8H2,1-3H3/t10-/m1/s1
InChIKeyQMVPMAAFGQKVCJ-SNVBAGLBSA-N
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
(R)-(+)-citronellol (CHEBI:10360) is a citronellol (CHEBI:50462)
(R)-(+)-citronellol (CHEBI:10360) is enantiomer of (S)-(−)-citronellol (CHEBI:88)
Incoming Relation(s)
(S)-(−)-citronellol (CHEBI:88) is enantiomer of (R)-(+)-citronellol (CHEBI:10360)
IUPAC Name 
(3R)-3,7-dimethyloct-6-en-1-ol
Synonym  Source
(R)-(+)-CitronellolKEGG COMPOUND
Manual XrefsDatabases
C09849KEGG COMPOUND
LMPR0102010008LIPID MAPS
C00003038KNApSAcK
C00000844KNApSAcK
Registry NumbersSources
Reaxys:1721506Reaxys
CAS:1117-61-9KEGG COMPOUND
CAS:1117-61-9ChemIDplus