CHEBI:90100 - (2R,4R)-rose oxide

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ChEBI Name (2R,4R)-rose oxide
ChEBI ID CHEBI:90100
ChEBI ASCII Name (2R,4R)-rose oxide
Definition A rose oxide in which both of the stereocentres have R configuration. It is also known as (−)-trans-rose oxide.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C10H18O
Net Charge 0
Average Mass 154.250
Monoisotopic Mass 154.136
InChI InChI=1S/C10H18O/c1-8(2)6-10-7-9(3)4-5-11-10/h6,9-10H,4-5,7H2,1-3H3/t9-,10+/m1/s1
InChIKey CZCBTSFUTPZVKJ-ZJUUUORDSA-N
SMILES C1CO[C@H](C[C@@H]1C)C=C(C)C
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
(via rose oxide )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (2R,4R)-rose oxide (CHEBI:90100) is a rose oxide (CHEBI:90075)
(2R,4R)-rose oxide (CHEBI:90100) is enantiomer of (2S,4S)-rose oxide (CHEBI:90103)
Incoming (2S,4S)-rose oxide (CHEBI:90103) is enantiomer of (2R,4R)-rose oxide (CHEBI:90100)
IUPAC Name
(2R,4R)-4-methyl-2-(2-methylprop-1-en-1-yl)tetrahydro-2H-pyran
Synonyms Sources
(−)-(2R,4R)-4-methyl-2-(2-methylprop-1-en-1-yl)tetrahydro-2H-pyran ChEBI
(−)-trans-rose oxide ChEBI
(2R,4R)-(−)-4-methyl-2-(2-methylprop-1-en-1-yl)tetrahydro-2H-pyran ChEBI
Registry Numbers Types Sources
1680588 Reaxys Registry Number Reaxys
5258-11-7 CAS Registry Number ChEBI
Citations Waiting for Citations Types Sources
25911965 PubMed citation Europe PMC
26126958 PubMed citation Europe PMC
Last Modified
26 October 2015