CHEBI:61737 - (+)-thujopsene

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (+)-thujopsene
ChEBI ID CHEBI:61737
Definition A thujopsene that has (R,R,R)-configuration.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C15H24
Net Charge 0
Average Mass 204.35110
Monoisotopic Mass 204.18780
InChI InChI=1S/C15H24/c1-11-6-9-14(4)8-5-7-13(2,3)15(14)10-12(11)15/h6,12H,5,7-10H2,1-4H3/t12-,14-,15-/m1/s1
InChIKey WXQGPFZDVCRBME-BPLDGKMQSA-N
SMILES CC1=CC[C@@]2(C)CCCC(C)(C)[C@]22C[C@H]12
ChEBI Ontology
Outgoing (+)-thujopsene (CHEBI:61737) is a thujopsene (CHEBI:61736)
(+)-thujopsene (CHEBI:61737) is enantiomer of (−)-thujopsene (CHEBI:9578)
Incoming (−)-thujopsene (CHEBI:9578) is enantiomer of (+)-thujopsene (CHEBI:61737)
IUPAC Name
(1aR,4aR,8aR)-2,4a,8,8-tetramethyl-1,1a,4,4a,5,6,7,8-octahydrocyclopropa[d]naphthalene
Synonym Source
(+)-thujopsene UniProt
Manual Xref Database
CPD-8236 MetaCyc
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Citations Waiting for Citations Types Sources
15918888 PubMed citation Europe PMC
15965019 PubMed citation Europe PMC
Last Modified
23 October 2012