CHEBI:50032 - (+)-α-thujene

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (+)-α-thujene
ChEBI ID CHEBI:50032
ChEBI ASCII Name (+)-alpha-thujene
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C10H16
Net Charge 0
Average Mass 136.23404
Monoisotopic Mass 136.12520
InChI InChI=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
InChIKey KQAZVFVOEIRWHN-UWVGGRQHSA-N
SMILES [H][C@@]12C[C@@]1(CC=C2C)C(C)C
ChEBI Ontology
Outgoing (+)-α-thujene (CHEBI:50032) is a α-thujene (CHEBI:50031)
(+)-α-thujene (CHEBI:50032) is enantiomer of (−)-α-thujene (CHEBI:50033)
Incoming (−)-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
Synonyms Sources
(+)-α-thujene UniProt
(1S,5R)-5-isopropyl-2-methylbicyclo[3.1.0]hex-2-ene IUPAC
Last Modified
29 April 2019