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CHEBI:90103 - (2S,4S)-rose oxide

ChEBI IDCHEBI:90103
ChEBI Name(2S,4S)-rose oxide
Stars
ASCII Name(2S,4S)-rose oxide
DefinitionA rose oxide in which both of the stereocentres have S configuration. It is also known as (+)-trans-rose oxide.
Last Modified26 October 2015
SubmitterGareth Owen
DownloadsMolfile
FormulaC10H18O
Net Charge0
Average Mass154.253
Monoisotopic Mass154.13577
SMILES[H][C@@]1(C=C(C)C)C[C@@H](C)CCO1
InChIInChI=1S/C10H18O/c1-8(2)6-10-7-9(3)4-5-11-10/h6,9-10H,4-5,7H2,1-3H3/t9-,10+/m0/s1
InChIKeyCZCBTSFUTPZVKJ-VHSXEESVSA-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)
(2S,4S)-rose oxide (CHEBI:90103) is a rose oxide (CHEBI:90075)
(2S,4S)-rose oxide (CHEBI:90103) is enantiomer of (2R,4R)-rose oxide (CHEBI:90100)
Incoming Relation(s)
(2R,4R)-rose oxide (CHEBI:90100) is enantiomer of (2S,4S)-rose oxide (CHEBI:90103)
IUPAC Name 
(2S,4S)-4-methyl-2-(2-methylprop-1-en-1-yl)tetrahydro-2H-pyran
Synonyms  Source
(+)-(2S,4S)-4-methyl-2-(2-methylprop-1-en-1-yl)tetrahydro-2H-pyranChEBI
(2S,4S)-(+)-4-methyl-2-(2-methylprop-1-en-1-yl)tetrahydro-2H-pyranChEBI
(+)-trans-rose oxideChemIDplus
trans-(+)-rose oxideChEBI
trans-(2S,4S)-(+)-rose oxideChemIDplus
Registry NumbersSources
Reaxys:1281400Reaxys
CAS:5258-10-6ChemIDplus