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CHEBI:50032 - (+)-α-thujene

ChEBI IDCHEBI:50032
ChEBI Name(+)-α-thujene
Stars
ASCII Name(+)-alpha-thujene
Last Modified29 April 2019
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC10H16
Net Charge0
Average Mass136.238
Monoisotopic Mass136.12520
SMILES[H][C@@]12C[C@]1(C(C)C)CC=C2C
InChIInChI=1S/C10H16/c1-7(2)10-5-4-8(3)9(10)6-10/h4,7,9H,5-6H2,1-3H3/t9-,10-/m0/s1
InChIKeyKQAZVFVOEIRWHN-UWVGGRQHSA-N
ChEBI Ontology
Outgoing Relation(s)
(+)-α-thujene (CHEBI:50032) is a α-thujene (CHEBI:50031)
(+)-α-thujene (CHEBI:50032) is enantiomer of (−)-α-thujene (CHEBI:50033)
Incoming Relation(s)
(−)-α-thujene (CHEBI:50033) is enantiomer of (+)-α-thujene (CHEBI:50032)
IUPAC Name 
(1S,5R)-2-methyl-5-(propan-2-yl)bicyclo[3.1.0]hex-2-ene
Synonym  Source
(1S,5R)-5-isopropyl-2-methylbicyclo[3.1.0]hex-2-eneIUPAC
UniProt Name  Source
(+)-α-thujeneUniProt